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N-(2-chloro-4-fluorophenyl)-2,2,2-trifluoroacetamide | 227946-49-8

中文名称
——
中文别名
——
英文名称
N-(2-chloro-4-fluorophenyl)-2,2,2-trifluoroacetamide
英文别名
——
N-(2-chloro-4-fluorophenyl)-2,2,2-trifluoroacetamide化学式
CAS
227946-49-8
化学式
C8H4ClF4NO
mdl
——
分子量
241.572
InChiKey
BWRDLNUQULVMAA-UHFFFAOYSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    2.8
  • 重原子数:
    15
  • 可旋转键数:
    1
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.12
  • 拓扑面积:
    29.1
  • 氢给体数:
    1
  • 氢受体数:
    5

反应信息

  • 作为反应物:
    描述:
    N-(2-chloro-4-fluorophenyl)-2,2,2-trifluoroacetamide甲基溴化镁potassium carbonate 作用下, 以 四氢呋喃甲醇 为溶剂, 反应 15.17h, 生成 2-chloro-3-cyclohex-2-en-1-yl-4-fluoroaniline
    参考文献:
    名称:
    室温下官能化苯胺和氨基取代的吡啶和吡嗪的邻位和间位放大
    摘要:
    一种实用的 邻位,间位,(或甚至邻位,邻位')的苯胺,氨基吡啶,并在室温下aminopyrazines的trifluoroacetamides的镁化用TMPMgCl⋅LiCl或TMP进行2 Mg⋅2的LiCl。这些放大倍数与几种羰基官能度相容,并允许以令人满意的产率获得多取代的苯胺。
    DOI:
    10.1002/anie.201205465
  • 作为产物:
    描述:
    2-氯-4-氟苯胺三氟乙酸酐三乙胺 作用下, 以 二氯甲烷 为溶剂, 反应 12.0h, 以95%的产率得到N-(2-chloro-4-fluorophenyl)-2,2,2-trifluoroacetamide
    参考文献:
    名称:
    室温下官能化苯胺和氨基取代的吡啶和吡嗪的邻位和间位放大
    摘要:
    一种实用的 邻位,间位,(或甚至邻位,邻位')的苯胺,氨基吡啶,并在室温下aminopyrazines的trifluoroacetamides的镁化用TMPMgCl⋅LiCl或TMP进行2 Mg⋅2的LiCl。这些放大倍数与几种羰基官能度相容,并允许以令人满意的产率获得多取代的苯胺。
    DOI:
    10.1002/anie.201205465
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文献信息

  • N-ARYLAMIDINE-SUBSTITUTED TRIFLUOROETHYL SULFIDE DERIVATIVES AS ACARICIDES AND INSECTICIDES
    申请人:BAYER CROPSCIENCE AG
    公开号:US20140315898A1
    公开(公告)日:2014-10-23
    The present invention relates to novel N-arylamide-substituted trifluoroethyl sulfide derivatives of the formula (I) in which X 1 , X 2 , X 3 , X 4 , R 1 , R 2 , R 3 , n have the meanings given in the description—to their use as acaricides and insecticides for controlling animal pests and to processes and intermediates for their preparation
    本发明涉及公式(I)中的新型N-芳酰胺取代三氟乙基硫醚衍生物,其中X1、X2、X3、X4、R1、R2、R3、n的含义如描述所示—它们作为杀螨剂和杀虫剂用于控制动物害虫,并涉及其制备的过程和中间体。
  • N-arylamidine-substituted trifluoroethyl sulfide derivatives as acaricides and insecticides
    申请人:BAYER CROPSCIENCE AG
    公开号:US10051861B2
    公开(公告)日:2018-08-21
    The present invention relates to novel N-arylamide-substituted trifluoroethyl sulfide derivatives of the formula (I) in which X1, X2, X3, X4, R1, R2, R3, n have the meanings given in the description—to their use as acaricides and insecticides for controlling animal pests and to processes and intermediates for their preparation.
    本发明涉及式 (I) 的新型 N-芳酰胺取代的三氟乙基硫醚衍生物 其中 X1、X2、X3、X4、R1、R2、R3、n 具有说明中给出的含义--用作控制动物害虫的杀螨剂和杀虫剂,以及制备它们的工艺和中间体。
  • [DE] HERBIZIDE 3-(BENZAZOL-4-YL)PYRIMIDINDION-DERIVATE<br/>[EN] HERBICIDES 3-(BENZAZOL-4-YL)PYRIMIDINE-DIONE-DERIVATIVES<br/>[FR] DERIVES DE 3-(BENZAZOL-4-YLE)DIONE DE PYRIMIDINE HERBICIDES
    申请人:BASF AKTIENGESELLSCHAFT
    公开号:WO1999031091A1
    公开(公告)日:1999-06-24
    (DE) 3-(Benzazol-4-yl)pyrimidindion-Derivate der Formel (I) und deren Salze, wobei X = O, S; R1 = H, NH2, C1-C6-Alkyl, C1-C6-Halogenalkyl; R2 = H, Halogen, C1-C6-Alkyl, C1-C6-Halogenalkyl, C1-C6-Alkylthio, C1-C6-Alkylsulfinyl, C1-C6-Alkylsulfonyl; R3 = H, Halogen, C1-C6-Alkyl; R4 = H, Halogen; R5 = CN, Halogen, C1-C6-Alkyl, C1-C6-Halogenalkyl, C1-C6-Alkoxy, C1-C6-Halogenalkoxy; =Y- = eine Gruppe =N-N(R6)-, =C(ZR7)-N(R6)-, =C(ZR7)-O-, =C(ZR7)-S-; R6 = C1-C6-Alkyl, C1-C4-Halogenalkyl, C3-C6-Cycloalkyl, C3-C6-Alkenyl, C3-C6-Alkinyl, C1-C6-Alkyl-SO2, C1-C6-Alkyl-CO, C1-C6-Halogenalkyl-CO, C1-C6-Alkyl-CS, C1-C6-Alkoxy-CO, C1-C6-Alkoxy-CS oder gegebenenfalls substituiertes C1-C6-Alkyl; Z = chemische Bindung, O, S, -S(O)-, -SO2-, -NH-, -N(R8)-; R7, R8 = C1-C6-Alkyl, C1-C6-Halogenalkyl, Hydroxy-C1-C4-alkyl, Cyano-C1-C4-alkyl, C1-C4-Alkoxy-C1-C4-alkyl, C1-C4-Halogenalkoxy-C1-C4-alkyl, C3-C4-Alkenyloxy-C1-C4-alkyl, C3-C4-Alkinyloxy-C1-C4-alkyl, C3-C8-Cycloalkoxy-C1-C4-alkyl, Amino-C1-C4-alkyl, C1-C4-Alkylamino-C1-C4-alkyl, Di(C1-C4-alkyl)amino-C1-C4-alkyl, C1-C4-Alkylthio-C1-C4-alkyl, C1-C4-Halogenalkylthio-C1-C4-alkyl, C3-C4-Alkenylthio-C1-C4-alkyl, C3-C4-Alkinylthio-C1-C4-alkyl, C1-C4-Alkylsulfinyl-C1-C4-alkyl, C1-C4-Halogenalkylsulfinyl-C1-C4-alkyl, C3-C4-Alkenylsulfinyl-C1-C4-alkyl, C3-C4-Alkinylsulfinyl-C1-C4-alkyl, C1-C4-Alkylsulfonyl-C1-C4-alkyl, C1-C4-Halogenalkylsulfonyl-C1-C4-alkyl, C3-C4-Alkenylsulfonyl-C1-C4-alkyl, C3-C4-Alkinylsulfonyl-C1-C4-alkyl, C3-C6-Alkenyl, Cyano-C3-C6-alkenyl, C3-C6-Halogenalkenyl, C3-C6-Alkinyl, Cyano-C3-C6-alkinyl, C3-C6-Halogenalkinyl, HO-CO-C1-C4-alkyl, (C1-C4-Alkoxy)CO-C1-C4-alkyl, (C1-C4-Alkyl-)CS-C1-C4-alkyl, H2N-CO-C1-C4-alkyl, C1-C4-Alkyl-NHCO-C1-C4-alkyl, Di(C1-C4-alkyl)NCO-C1-C4-alkyl, Di(C1-C4-alkyl)phosphonyl-C1-C4-alkyl, gegebenenfalls substituiertes C3-C8-Cyclo-alkyl, C3-C8-Cycloalkyl-C1-C4-alkyl, Phenyl, Phenyl-C1-C4-alkyl, 3- bis 7-gliedriges Heterocyclyl oder Heterocyclyl-C1-C4-alkyl, wobei jeder Heterocyclyl-Ring ein CO- oder CS-Ringglied enthalten kann, oder, sofern Z = chemische Bindung, R7 auch H, OH, CN, SH, NH2, Halogen, -CH(OH)-CH2-R9, -CH(Halogen)-CH2-R9, -CH2-CH(Halogen)-R9, -CH=CH-R9 oder -CH=C(Halogen)-R9, wobei R9 = COOH, (C1-C4-Alkoxy)carbonyl, (C1-C4-Alkythio)carbonyl, CONH2, C1-C4-Alkyl-NHCO oder Di(C1-C4-alkyl)NCO, oder R7 + R8 = gegebenenfalls substituierte 1,3-Propylen- ,Tetramethylen-, Pentamethylen- oder Ethylenoxyethylen-Kette.(EN) The invention relates to 3-(benzazol-4-yl)pyrimidine-dione-derivatives of formula (I) and the salts thereof, whereby X = O, S; R1 = H, NH2, C1-C6-alkyl, C1-C6-alkyl halide; R2 = H, halogen, C1-C6-alkyl, C1-C6-alkyl halide, C1-C6-alkylthio, C1-C6-alkylsulfinyl, C1-C6-alkylsulfonyl; R3 = H, halogen, C1-C6-alkyl; R4 = H, halogen; R5 = CN, halogen, C1-C6-alkyl, C1-C6-alkyl halide, C1-C6-alkoxyl, C1-C6-alkoxyl halide; =Y- = a group =N-N(R6)-, =C(ZR7)-N(R6)-, =C(ZR7)-O-, =C(ZR7)-S-; R6 = C1-C6-alkyl, C1-C4-alkyl halide, C3-C6-cycloalkyl, C3-C6-alkenyl, C3-C6-alkynyl, C1-C6-alkyl-SO2, C1-C6-alkyl-CO, C1-C6-alkyl halide-CO, C1-C6-alkyl-CS, C1-C6-alkoxyl-CO, C1-C6-alkoxyl-CS or optionally substituted C1-C6-alkyl; Z = chemical bond, O, S, -S(O)-, -SO2-, -NH-, -N(R8)-; R7, R8 = C1-C6-alkyl, C1-C6-alkyl halide, hydroxy-C1-C4-alkyl, cyano-C1-C4-alkyl, C1-C4-alkoxyl-C1-C4-alkyl, C1-C4-alkoxyl halide-C1-C4-alkyl, C3-C4-alkenyloxyl-C1-C4-alkyl, C3-C4-alkynyloxyl-C1-C4-alkyl, C3-C8-cycloalkoxyl-C1-C4-alkyl, amino-C1-C4-alkyl, C1-C4-alkylamino-C1-C4-alkyl, di(C1-C4-alkyl)amino-C1-C4-alkyl, C1-C4-alkylthio-C1-C4-alkyl, C1-C4-alkylthio halide-C1-C4-alkyl, C3-C4-alkenylthio-C1-C4-alkyl, C3-C4-alkynylthio-C1-C4-alkyl, C1-C4-alkylsulfinyl-C1-C4-alkyl, C1-C4-alkylsulfinyl halide-C1-C4-alkyl, C3-C4-alkenylsulfinyl-C1-C4-alkyl, C3-C4-alkynylsulfinyl-C1-C4-alkyl, C3-C6-alkenyl, cyano-C3-C6-alkenyl, C3-C6-alkenyl halide, C3-C6-alkynyl, cyano-C3-C6-alkynyl, C3-C6-alkynyl halide, HO-CO-C1-C4-alkyl, (C1-C4-alkoxyl)CO-C1-C4-alkyl, (C1-C4-alkyl)CS-C1-C4-alkyl, H2N-CO-C1-C4-alkyl, C1-C4-alkyl-NHCO-C1-C4-alkyl, di(C1-C4-alkyl)NCO-C1-C4-alkyl, di(C1-C4-alkyl)phosphonyl-C1-C4-alkyl, optionally substituted C3-C8-cycloalkyl, C3-C8-cycloalkyl-C1-C4-alkyl, phenyl, phenyl-C1-C4-alkyl, 3- to 7-linked heterocyclyl or heterocyclyl-C1-C4-alkyl, whereby each heterocyclyl ring can contain a CO-ring link or CS-ring link, or provided that Z = chemical bond, R7 also H, OH, CN, SH, NH2, halogen, -CH(OH)-CH2-R9, -CH(halogen)-CH2-R9, -CH2-CH(halogen)-R9, -CH=CH-R9 or -CH=C(halogen)-R9, whereby R9 = COOH, (C1-C4-alkoxyl)carbonyl, (C1-C4-alkylthio)carbonyl, CONH2, C1-C4-alkyl-NHCO or di(C1-C4-alkyl)NCO, or R7 + R8 = an optionally substituted 1,3-propylene-, tetramethylene-, pentamethylene- or ethylene oxyethylene-chain.(FR) L'invention concerne des dérivés 3-(benzazol-4-yle)dione de pyrimidine de la formule (I) et leurs sels. Dans cette formule, X = O, S; R1 = H, NH2, alkyle C1-C6, halogénure d'alkyle C1-C6; R2 = H, halogène, alkyle C1-C6, halogénure d'alkyle, alkylthio C1-C6, alkylsulfinyle C1-C6, alkylsulfonyle C1-C6; R3 = H, halogène, alkyle C1-C6; R4 = H, halogène; R5 = CN, halogène, alkyle C1-C6, halogénure d'alkyle C1-C6, alcoxy C1-C6, halogénure d'alcoxy C1-C6; =Y- = un groupe =N-N(R6)-, =C(ZR7)-N(R6)-, =C(ZR7)-O-, =C(ZR7)-S-; R6 = alkyle C1-C6, halogénure d'alkyle C1-C4, cycloalkyle C3-C6, alkényle C3-C6, alkinyle C3-C6, alkyle C1-C6-SO2, alkyle C1-C6-CO, halogénure d'alkyle C1-C6-CO, alkyle C1-C6-CS, alcoxy C1-C6-CO, alcoxy C1-C6-CS ou alkyle C1-C6 éventuellement substitué; Z = liaison chimique, O, S, -S(O)-, -SO2-, -NH-, -N(R8)-; R7, R8 = alkyle C1-C6, halogénure d'alkyle C1-C6, hydroxy-alkyle C1-C4, cyano-alkyle C1-C4, alcoxy C1-C4-alkyle C1-C4, halogénure d'alcoxy C1-C4-alkyle C1-C4, alkényloxy C3-C4-alkyle C1-C4, alkinyloxy C3-C4-alkyle C1-C4, cycloalkoxy C3-C8-alkyle C1-C4, amino-alkyle C1-C4, alkylamino C1-C4-alkyle C1-C4, di(alkyle C1-C4)amino-alkyle C1-C4, alkylthio C1-C4-alkyle C1-C4, halogénure d'alkylthio C1-C4, alkénylthio C3-C4-alkyle C1-C4, alkinylthio C3-C4-alkyle C1-C4, alkylsulfinyle C1-C4-alkyle C1-C4, halogénure d'alkylsulfinyle C1-C4-alkyle C1-C4-alkénylsulfinyle C3-C4-alkyle C1-C4, alkinylsulfinyle C3-C4-alkyle C1-C4, alkylsulfonyle C1-C4-alkyle C1-C4, halogénure d'alkylsulfonyle C1-C4-alkyle C1-C4, alkénylsulfonyle C3-C4-alkyle C1-C4, alkinylsulfonyle C3-C4-alkyle C1-C4, alkényle C3-C6, cyano-alkényle C3-C6, halogénure d'alkényle C3-C6, alkinyle C3-C6, cyano-alkinyle C3-C6, halogénure d'alkinyle C3-C6, HO-CO-alkyle C1-C4, (alcoxy C1-C4)CO-alkyle C1-C4, (alkyle C1-C4)CS-alkyle C1-C4, H2N-CO-alkyle C1-C4, alkyle C1-C4-NHCO-alkyle C1-C4, di(alkyle C1-C4)NCO-alkyle C1-C4, di(alkyle C1-C4)phosphonyle-alkyle C1-C4, cycloalkyle C3-C8 éventuellement substitué, cycloalkyle C3-C8-alkyle C1-C4, phényle, phényle-alkyle C1-C4, hétérocyclyle ayant entre 3 et 7 chaînons ou hétérocyclyle-alkyle C1-C4, chaque composé hétérocyclyle pouvant contenir un chaînon cyclique CS, ou si Z = liaison chimique, R7 désigne également H, OH, CN, SH, NH2, halogène, -CH(OH)-CH2-R9, -CH(halogène)-R9, R9 = COOH, (alcoxy C1-C4)carbonyle, (alkylthio C1-C4)carbonyle, CONH2, alkyle C1-C4-NHCO ou di(alkyle C1-C4)NCO, ou R7 + R8 = chaîne de 1,3-propylène-tétraméthylène, de pentaméthylène ou d'oxyéthylène d'éthylène, éventuellement substituée.
    (DE)本发明涉及具有式(I)的3-(苯并杂环-4-基)嘧啶二酮衍生物及其盐,其中X=O,S;R₁=H,NH₂,C₁-C₆烷基,C₁-C₆卤代烷基;R₂=H,卤素,C₁-C₆烷基,C₁-C₆卤代烷基,C₁-C₆烷硫基,C₁-C₆亚磺酰基,C₁-C₆磺酰基;R₃=H,卤素,C₁-C₆烷基;R₄=H,卤素;R₅=CN,卤素,C₁-C₆烷基,C₁-C₆卤代烷基,C₁-C₆烷氧基,C₁-C₆卤代烷氧基;=Y-为=N-N(R₆)-,=C(ZR₇)-N(R₆)-,=C(ZR₇)-O-,=C(ZR₇)-S-;R₆=C₁-C₆烷基,C₁-C₄卤代烷基,C₃-C₆环烷基,C₃-C₆烯基,C₃-C₆炔基,C₁-C₆烷基-SO₂,C₁-C₆烷基-CO,C₁-C₆卤代烷基-CO,C₁-C₆烷基-CS,C₁-C₆烷氧基-CO,C₁-C₆烷氧基-CS或C₁-C₆烷基(任选取代);Z=化学键,O,S,-S(O)-,-SO₂-,-NH-,-N(R₈)-;R₇,R₈=C₁-C₆烷基,C₁-C₆卤代烷基,羟基-C₁-C₄烷基,氰基-C₁-C₄烷基,C₁-C₄烷氧基-C₁-C₄烷基,C₁-C₄卤代烷氧基-C₁-C₄烷基,C₃-C₄烯氧基-C₁-C₄烷基,C₃-C₄炔氧基-C₁-C₄烷基,C₃-C₈环烷氧基-C₁-C₄烷基,氨基-C₁-C₄烷基,C₁-C₄烷氨基-C₁-C₄烷基,二(C₁-C₄烷基)氨基-C₁-C₄烷基,C₁-C₄烷硫基-C₁-C₄烷基,C₁-C₄卤代烷硫基-C₁-C₄烷基,C₃-C₄烯硫基-C₁-C₄烷基,C₃-C₄炔硫基-C₄烷基,C₁-C₄烷亚磺基-C₁-C₄烷基,C₁-C₄卤代烷亚磺基-C₁-C₄烷基,C₃-C₄烯亚磺基-C₁-C₄烷基,C₃-C₄炔亚磺基-C₁-C₄烷基,C₁-C₄烷磺基-C₁-C₄烷基,C₁-C₄卤代烷磺基-C₁-C₄烷基,C₃-C₄烯磺基-C₁-C₄烷基,C₃-C₄炔磺基-C₁-C₄烷基,C₃-C₆烯基,氰基-C₃-C₆烯基,C₃-C₆卤代烯基,C₃-C₆炔基,氰基-C₃-C₆炔基,C₃-C₆卤代炔基,HO-CO-C₁-C₄烷基,(C₁-C₄烷氧基)CO-C₁-C₄烷基,(C₁-C₄烷基)CS-C₁-C₄烷基,H₂N-CO-C₁-C₄烷基,C₁-十一烷基-NHCO-C₁-C₄烷基,二(C₁-C₄烷基)NCO-C₁-C₄烷基,二(C₁-C₄烷基)磷酸基-C₁-C₄烷基,C₃-C₈环烷基(任选取代),C₃-C₈环烷基-C₁-C₄烷基,苯基,苯基-C₁-C₄烷基,3-至7-员杂环基或杂环基-C₁-C₄烷基,其中每个杂环基环可含一个CO-环键或CS-环键;或者,若Z=化学键,R₇还可为H,OH,CN,SH,NH₂,卤素,-CH(OH)-CH₂-R₉,-CH(卤素)-CH₂-R₉,-CH₂-CH(卤素)-R₉,-CH=CH-R₉或-CH=C(卤素)-R₉,其中R₉=COOH,(C₁-C₄烷氧基)羰基,(C₁-C₄烷硫基)羰基,CONH₂,C₁-C₄烷基-NHCO,或二(C₁-C₄烷基)NCO;或R₇+R₈=任选取代的1,3-丙二烯基,四亚甲基,五亚甲基或氧二亚甲基链。 (EN)发明涉及式(I)的3-(苯并杂环-4-基)嘧啶二酮衍生物及其盐,其中X=O,S;R₁=H,NH₂,C₁-C₆烷基,C₁-C₆卤代烷基;R₂=H,卤素,C₁-C₆烷基,C₁-C₆卤代烷基,C₁-C₆烷硫基,C₁-C₆亚磺酰基,C₁-C₆磺酰基;R₃=H,卤素,C₁-C₆烷基;R₄=H,卤素;R₅=CN,卤素,C₁-C₆烷基,C₁-C₆卤代烷基,C₁-C₆烷氧基,C₁-C₆卤代烷氧基;=Y-为=N-N(R₆)-,=C(ZR₇)-N(R₆)-,=C(ZR₇)-O-,=C(ZR₇)-S-;R₆=C₁-C₆烷基,C₁-C₄卤代烷基,C₃-C₆环烷基,C₃-C₆烯基,C₃-C₆炔基,C₁-C₆烷基-SO₂,C₁-C₆烷基-CO,C₁-C₆卤代烷基-CO,C₁-C₆烷基-CS,C₁-C₆烷氧基-CO,C₁-C₆烷氧基-CS或C₁-C₆烷基(任选取代);Z=化学键,O,S,-S(O)-,-SO₂-,-NH-,-N(R₈)-;R₇,R₈=C₁-C₆烷基,C₁-C₆卤代烷基,羟基-C₁-C₄烷基,氰基-C₁-C₄烷基,C₁-C₄烷氧基-C₁-C₄烷基,C₁-C₄卤代烷氧基-C₁-C₄烷基,C₃-C₄烯氧基-C₁-C₄烷基,C₃-C₄炔氧基-C₁-C₄烷基,C₃-C₈环烷氧基-C₁-C₄烷基,氨基-C₁-C₄烷基,C₁-C₄烷氨基-C₁-C₄烷基,二(C₁-C₄烷基)氨基-C₁-C₄烷基,C₁-C₄烷硫基-C₁-C⁻烷基,C₁-C₄卤代烷硫基-C₁-C₄烷基,C₃-C₄烯硫基-C₁-C₄烷基,C₃-C₄炔硫基-C₁-C₄烷基,C₁-C₄烷亚磺基-C₁-C₄烷基,C₁-C₄卤代烷亚磺基-C₁-C₄烷基,C₃-C₄烯亚磺基-C₁-C₄烷基,C₃-C₄炔亚磺基-C₁-C₄烷基,C₁-C₄烷磺基-C₁-C₄烷基,C₁-C₄卤代烷磺基-C₁-C₄烷基,C₃-C₄烯磺基-C₁-C₄烷基,C₃-C₄炔磺基-C₁-C₄烷基,C₃-C₆烯基,氰基-C₃-C₆烯基,C₃-C₆卤代烯基,C₃-C₆炔基,氰基-C₃-C₆炔基,C₃-C₆卤代炔基,HO-CO-C₁-C₄烷基,(C₁-C₄烷氧基)CO-C₁-C₄烷基,(C₁-C₄烷基)CS-C₁-C₄烷基,H₂N-CO-C₁-C₄烷基,C₁-C₄烷基-NHCO-C₁-C₄烷基,二(C₁-C₄烷基)NCO-C₁-C₄烷基,二(C₁-C₄烷基)磷酸基-C₁-C₄烷基,C₃-C₈环烷基(任选取代),C₃-C₈环烷基-C₁-C₄烷基,苯基,苯基-C₁-C₄烷基,3-至7-员杂环基或杂环基-C₁-C₄烷基,其中每个杂环基环可含一个CO-环键或CS-环键;或者,若Z=化学键,R₇还可为H,OH,CN,SH,NH₂,卤素,-CH(OH)-CH₂-R₉,-CH(卤素)-CH₂-R₉,-CH₂-CH(卤素)-R₉,-CH=CH-R₉或-CH=C(卤素)-R₉,其中R₉=COOH,(C₁-C₄烷氧基)羰基,(C₁-C₄烷硫基)羰基,CONH₂,C₁-C₄烷基-NHCO,或二(C₁-C₄烷基)NCO;或R₇+R₈=任选取代的1,3-丙二烯基,四亚甲基,五亚甲基或氧二亚甲基链。 (FR)发明涉及式(I)的3-(苯并杂环-4-基)嘧啶二酮衍生物及其盐,其中X=O,S;R₁=H,NH₂,C₁-C₆烷基,C₁-C₆卤代烷基;R₂=H,卤素,C₁-C₆烷基,C₁-C₆卤代烷基,C₁-C₆烷硫基,C₁-C₆亚磺酰基,C₁-C₆磺酰基;R₃=H,卤素,C₁-C₆烷基;R₄=H,卤素;R₅=CN,卤素,C₁-C₆烷基,C₁-C₆卤代烷基,C₁-C₆烷氧基,C₁-C₆卤代烷氧基;=Y-为=N-N(R₆)-,=C(ZR₇)-N(R₆)-,=C(ZR₇)-O-,=C(ZR₇)-S-;R₆=C₁-C₆烷基,C₁-C₄卤代烷基,C₃-C₆环烷基,C₃-C₆烯基,C₃-C₆炔基,C₁-C₆烷基-SO₂,C₁-C₆烷基-CO,C₁-C₆卤代烷基-CO,C₁-C₆烷基-CS,C₁-C₆烷氧基-CO,C₁-C₆烷氧基-CS或C₁-C₆烷基(任选取代);Z=化学键,O,S,-S(O)-,-SO₂-,-NH-,-N(R₈)-;R₇,R₈=C₁-C₆烷基,C₁-C₆卤代烷基,羟基-C₁-C₄烷基,氰基-C₁-C₄烷基,C₁-C₄烷氧基-C₁-C₄烷基,C₁-C₄卤代烷氧基-C₁-C₄烷基,C₃-C₄烯氧基-C₁-C₄烷基,C₃-C₄炔氧基-C₁-C₄烷基,C₃-C₈环烷氧基-C₁-C₄烷基,氨基-C₁-C₄烷基,C₁-C₄烷氨基-C₁-C₄烷基,二(C₁-C₄烷基)氨基-C₁-C₄烷基,C₁-C₄烷硫基-C₁-C₄烷基,C₁-C₄卤代烷硫基-C₁-C₄烷基,C₃-C₄烯硫基-C₁-C₄烷基,C₃-C₄炔硫基-C₁-C₄烷基,C₁-C₄烷亚磺基-C₁-C₄烷基,C₁-C₄卤代烷亚磺基-C₁-C₄烷基,C₃-C₄烯亚磺基-C₁-C₄烷基,C₃-C₄炔亚磺基-C₁-C₄烷基,C₁-C₄烷磺基-C₁-C₄烷基,C₁-C₄卤代烷磺基-C₁-C₄烷基,C₃-C₄烯磺基-C₁-C₄烷基,C₃-C₄炔磺基-C₁-C₄烷基,C₃-C₆烯基,氰基-C₃-C₆烯基,C₃-C₆卤代烯基,C₃-C₆炔基,氰基-C₃-C₆炔基,C₃-C₆卤代炔基,HO-CO-C₁-C₄烷基,(C₁-C₄烷氧基)CO-C₁-C₄烷基,(C₁-C₄烷基)CS-C₁-C₄烷基,H₂N-CO-C₁-C₄烷基,C₁-C₄烷基-NHCO-C₁-C₄烷基,二(C₁-C₄烷基)NCO-C₁-C₄烷基,二(C₁-C₄烷基)磷酸基-C₁-C₄烷基,C₃-C₈环烷基(任选取代),C₃-C₈环烷基-C₁-C₄烷基,苯基,苯基-C₁-C₄烷基,3-至7-员杂环基或杂环基-C₁-C₄烷基,其中每个杂环基环可含一个CO-环键或CS-环键;或者,若Z=化学键,R₇还可为H,OH,CN,SH,NH₂,卤素,-CH(OH)-CH₂-R₉,-CH(卤素)-CH₂-R₉,-CH₂-CH(卤素)-R₉,-CH=CH-R₉或-CH=C(卤素)-R₉,其中R₉=COOH,(C₁-C₄烷氧基)羰基,(C₁-C₄烷硫基)羰基,CONH₂,C₁-C₄烷基-NHCO,或二(C₁-C₄烷基)NCO;或R₇+R₈=任选取代的1,3-丙二烯基,四亚甲基,五亚甲基或氧二亚甲基链。
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(βS)-β-氨基-4-(4-羟基苯氧基)-3,5-二碘苯甲丙醇 (S)-(-)-7'-〔4(S)-(苄基)恶唑-2-基]-7-二(3,5-二-叔丁基苯基)膦基-2,2',3,3'-四氢-1,1-螺二氢茚 (S)-盐酸沙丁胺醇 (S)-3-(叔丁基)-4-(2,6-二甲氧基苯基)-2,3-二氢苯并[d][1,3]氧磷杂环戊二烯 (S)-2,2'-双[双(3,5-三氟甲基苯基)膦基]-4,4',6,6'-四甲氧基联苯 (S)-1-[3,5-双(三氟甲基)苯基]-3-[1-(二甲基氨基)-3-甲基丁烷-2-基]硫脲 (R)富马酸托特罗定 (R)-(-)-盐酸尼古地平 (R)-(+)-7-双(3,5-二叔丁基苯基)膦基7''-[((6-甲基吡啶-2-基甲基)氨基]-2,2'',3,3''-四氢-1,1''-螺双茚满 (R)-3-(叔丁基)-4-(2,6-二苯氧基苯基)-2,3-二氢苯并[d][1,3]氧杂磷杂环戊烯 (R)-2-[((二苯基膦基)甲基]吡咯烷 (N-(4-甲氧基苯基)-N-甲基-3-(1-哌啶基)丙-2-烯酰胺) (5-溴-2-羟基苯基)-4-氯苯甲酮 (5-溴-2-氯苯基)(4-羟基苯基)甲酮 (5-氧代-3-苯基-2,5-二氢-1,2,3,4-oxatriazol-3-鎓) (4S,5R)-4-甲基-5-苯基-1,2,3-氧代噻唑烷-2,2-二氧化物-3-羧酸叔丁酯 (4-溴苯基)-[2-氟-4-[6-[甲基(丙-2-烯基)氨基]己氧基]苯基]甲酮 (4-丁氧基苯甲基)三苯基溴化磷 (3aR,8aR)-(-)-4,4,8,8-四(3,5-二甲基苯基)四氢-2,2-二甲基-6-苯基-1,3-二氧戊环[4,5-e]二恶唑磷 (2Z)-3-[[(4-氯苯基)氨基]-2-氰基丙烯酸乙酯 (2S,3S,5S)-5-(叔丁氧基甲酰氨基)-2-(N-5-噻唑基-甲氧羰基)氨基-1,6-二苯基-3-羟基己烷 (2S,2''S,3S,3''S)-3,3''-二叔丁基-4,4''-双(2,6-二甲氧基苯基)-2,2'',3,3''-四氢-2,2''-联苯并[d][1,3]氧杂磷杂戊环 (2S)-(-)-2-{[[[[3,5-双(氟代甲基)苯基]氨基]硫代甲基]氨基}-N-(二苯基甲基)-N,3,3-三甲基丁酰胺 (2S)-2-[[[[[[((1R,2R)-2-氨基环己基]氨基]硫代甲基]氨基]-N-(二苯甲基)-N,3,3-三甲基丁酰胺 (2-硝基苯基)磷酸三酰胺 (2,6-二氯苯基)乙酰氯 (2,3-二甲氧基-5-甲基苯基)硼酸 (1S,2S,3S,5S)-5-叠氮基-3-(苯基甲氧基)-2-[(苯基甲氧基)甲基]环戊醇 (1-(4-氟苯基)环丙基)甲胺盐酸盐 (1-(3-溴苯基)环丁基)甲胺盐酸盐 (1-(2-氯苯基)环丁基)甲胺盐酸盐 (1-(2-氟苯基)环丙基)甲胺盐酸盐 (-)-去甲基西布曲明 龙胆酸钠 龙胆酸叔丁酯 龙胆酸 龙胆紫 龙胆紫 齐达帕胺 齐诺康唑 齐洛呋胺 齐墩果-12-烯[2,3-c][1,2,5]恶二唑-28-酸苯甲酯 齐培丙醇 齐咪苯 齐仑太尔 黑染料 黄酮,5-氨基-6-羟基-(5CI) 黄酮,6-氨基-3-羟基-(6CI) 黄蜡,合成物 黄草灵钾盐