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2,3-dichloro-5-(methylthio)pyridine | 203731-39-9

中文名称
——
中文别名
——
英文名称
2,3-dichloro-5-(methylthio)pyridine
英文别名
2,3-Dichloro-5-(methylsulfanyl)pyridine;2,3-dichloro-5-methylsulfanylpyridine
2,3-dichloro-5-(methylthio)pyridine化学式
CAS
203731-39-9
化学式
C6H5Cl2NS
mdl
——
分子量
194.084
InChiKey
BAYSIKMUOGEESD-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

物化性质

  • 沸点:
    272.5±40.0 °C(Predicted)
  • 密度:
    1.43±0.1 g/cm3(Predicted)

计算性质

  • 辛醇/水分配系数(LogP):
    3
  • 重原子数:
    10
  • 可旋转键数:
    1
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.17
  • 拓扑面积:
    38.2
  • 氢给体数:
    0
  • 氢受体数:
    2

上下游信息

  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

点击查看最新优质反应信息

文献信息

  • [EN] ORGANOSILICON COMPOUNDS AND THEIR USE AS THE MODULATORS OF THE TRPV1 RECEPTOR<br/>[FR] COMPOSÉS D'ORGANOSILICIUM ET LEUR UTILISATION EN TANT QUE MODULATEURS DU RÉCEPTEUR TRPV1
    申请人:TAKEDA PHARMACEUTICAL
    公开号:WO2010092342A1
    公开(公告)日:2010-08-19
    A compound having the Formula (1): wherein: X1, X2, X3 and X4 independently represent CH or N; R1, R2 and R3 independently represent C1-6 alkyl, C3-8 cycloalkyl or C3-8 cycloalky IC1-6alkyl, each of which groups may be optionally substituted with one or more substituents independently selected from halogen and haloC1-6 alkyl; R4, R5, R6, R7, R8 and R9 independently represent H, C1-6 alkyl, C3-8 cycloalkyl or -QI-OR14, or R4 and R9 may join to form a bridging C1-6 alkylene chain; R10 represents aryl or heteroaryl, each of which may be optionally substituted by one or more substituents, independently selected from halogen, C1-6 alkyl, haloC1-6 alkyl, hydroxyC1-6alkyl, haloC1-6 alkoxy, cyano, -Q2-CO2R12, -Q2-COR12, -Q2-CONR12R13, -Q2-OR12, -Q2-NR12Rn, -Q2-NR12SO2R13, -Q2- NR12COR13, -Q2-SO2NR12R13, -Q2-S(O)mR12, -Y-aryl, -Y-heteroaryl, -Y-C3-8 cycloalkyl and -Y-heterocyclyl; Q1 and Q2 independently represent a covalent bond, C1-6 alkylene, or 1-6 alkylene substituted with hydroxy; R12 and R13 independently represent a H atom, or a C1-6 alkyl or C3-8 cycloalkyl group, in which each group may be optionally substituted with one or more C1-6 alkoxy; or when R12 and R13 are attached to the same nitrogen atom they may join to form a nitrogen containing heterocyclyl ring, which may be optionally substituted with one or more substituents independently selected from C1-6 alkyl and C1-6 alkoxy; R14 represents a H atom, or a C1-6 alkyl or C3-8 cycloalkyl group, in which each group may be optionally substituted with one or more C1-6 alkoxy; Y represents a covalent bond, C1-6 alkylene, or -O-. m represents 0, 1 or 2; R11, which is optionally present and may be attached to any available carbon atom X1 to X4 instead of H, represents halogen, haloC1-6alkyl, C1-6alkoxy, haloC1-6alkoxy, cyano or C1-6 alkyl which may be optionally substituted with one or more substituents independently selected from halogen, haloC1-6 alkyl and OR16; q represents 0, 1 or 2; W represents -(CH2)n-, which may be optionally substituted with one or more substituents independently selected from C1-6 alkyl, C3-8 cycloalkyl and -Q3-OR15; n represents 1 or 2; Q3 represents a covalent bond or C1-6 alkylene; R15 represents H, C1-6 alkyl, or C3-8 cycloalkyl; R16 is as defined for R14; or a pharmaceutically acceptable salt or ester thereof. Uses of the compounds as modulators of the TrpVl receptor are also disclosed.
    一种具有以下化学式(1)的化合物:其中:X1、X2、X3和X4分别代表CH或N;R1、R2和R3分别代表C1-6烷基,C3-8环烷基或C3-8环烷基C1-6烷基,每个基团可以选择性地被一个或多个取代基取代,所述取代基独立地选自卤素和卤代C1-6烷基;R4、R5、R6、R7、R8和R9分别代表H、C1-6烷基,C3-8环烷基或-QI-OR14,或者R4和R9可以连接形成一个桥接的C1-6亚烷基链;R10代表芳基或杂环芳基,每个基团可以选择性地被一个或多个取代基取代,独立地选自卤素、C1-6烷基、卤代C1-6烷基、羟基C1-6烷基、卤代C1-6烷氧基、氰基、-Q2-CO2R12、-Q2-COR12、-Q2-CONR12R13、-Q2-OR12、-Q2-NR12Rn、-Q2-NR12SO2R13、-Q2-NR12COR13、-Q2-SO2NR12R13、-Q2-S(O)mR12、-Y-芳基、-Y-杂环芳基、-Y-C3-8环烷基和-Y-杂环烷基;Q1和Q2独立地代表共价键、C1-6亚烷基或用羟基取代的1-6亚烷基;R12和R13独立地代表H原子,或C1-6烷基或C3-8环烷基基团,其中每个基团可以选择性地被一个或多个C1-6烷氧基取代;或者当R12和R13连接到同一个氮原子时,它们可以连接形成一个含氮的杂环烷基环,该环可以选择性地被一个或多个取代基取代,独立地选自C1-6烷基和C1-6烷氧基;R14代表H原子,或C1-6烷基或C3-8环烷基基团,其中每个基团可以选择性地被一个或多个C1-6烷氧基取代;Y代表共价键、C1-6亚烷基或-O-。m代表0、1或2;R11(可选地出现并且可以连接到任何可用的碳原子X1到X4代替H)代表卤素、卤代C1-6烷基、C1-6烷氧基、卤代C1-6烷氧基、氰基或C1-6烷基,可以选择性地被一个或多个取代基取代,独立地选自卤素、卤代C1-6烷基和OR16;q代表0、1或2;W代表-(CH2)n-,可以选择性地被一个或多个取代基取代,独立地选自C1-6烷基、C3-8环烷基和-Q3-OR15;n代表1或2;Q3代表共价键或C1-6亚烷基;R15代表H、C1-6烷基或C3-8环烷基;R16如R14所定义;或其药学上可接受的盐或酯。还公开了该化合物作为TrpV1受体调节剂的用途。
  • [EN] PHD INHIBITOR COMPOUNDS, COMPOSITIONS, AND THEIR USE<br/>[FR] COMPOSÉS INHIBITEURS DE PHD, COMPOSITIONS ET LEUR UTILISATION
    申请人:AKEBIA THERAPEUTICS INC
    公开号:WO2021188944A1
    公开(公告)日:2021-09-23
    The present invention provides, in part, novel small molecule inhibitors of PHD, having a structure according to Formula (A), and sub-formulas thereof: or a pharmaceutically acceptable salt thereof. The compounds provided herein can be useful for treatment of diseases including heart (e.g. ischemic heart disease, congestive heart failure, and valvular heart disease), lung (e.g., acute lung injury, pulmonary hypertension, pulmonary fibrosis, and chronic obstructive pulmonary disease), liver (e.g. acute liver failure and liver fibrosis and cirrhosis), and kidney (e.g. acute kidney injury and chronic kidney disease) disease.
    本发明部分提供了PHD的新型小分子抑制剂,其结构符合式(A)及其子式:或其药用可接受的盐。本文提供的化合物可用于治疗包括心脏(如缺血性心脏病、充血性心力衰竭和瓣膜心脏病)、肺(如急性肺损伤、肺动脉高压、肺纤维化和慢性阻塞性肺疾病)、肝(如急性肝衰竭和肝纤维化和肝硬化)和肾(如急性肾损伤和慢性肾病)疾病。
  • [EN] SUBSTITUTED HALOGEN(THIO)ACYL COMPOUNDS<br/>[FR] COMPOSÉS D'HALOGÈNE (THIO) ACYLE SUBSTITUÉS
    申请人:BAYER CROPSCIENCE AG
    公开号:WO2018019711A1
    公开(公告)日:2018-02-01
    The present invention relates to novel substituted halogen(thio)acyl compounds according to formula (I), to processes for their preparation and to their use for controlling animal pests, especially arthropods, particular insects.
    本发明涉及一种新型的取代卤(硫)酰基化合物,其化学式为(I),其制备方法以及其用于控制动物害虫,尤其是节肢动物,特别是昆虫的应用。
  • [DE] SUBSTITUIERTE 2-ARYLPYRIDINE ALS HERBIZIDE<br/>[EN] SUBSTITUTED 2-ARYLPYRIDINE AS HERBICIDE<br/>[FR] ARYLPYRIDINE SUBSTITUEE EN 2 UTILISEE COMME HERBICIDE
    申请人:BASF AKTIENGESELLSCHAFT
    公开号:WO1998007720A1
    公开(公告)日:1998-02-26
    (DE) Substituierte 2-Arylpyridine (I) und deren Salze, wobei R1 = SH, SO2OH, SO2C1, SO2NH2, C1-C6-Alkylthio, C1-C6-Alkylsulfinyl, C1-C6-Alkylsulfonyl, C1-C6-Alkylaminosulfonyl, Di(C1-C6-alkyl)aminosulfonyl; R2, R3 = H, Halogen; R4 = H, C1-C6-Alkyl, C1-C6-Halogenalkyl, Cyano-C1-C6-alkyl, C1-C6-Alkoxy, C1-C6-Alkoxy-C1-C6-alkyl, C1-C4-Halogenalkoxy-C1-C4-alkyl, C1-C6-Alkylthio-C1-C6-alkyl, C1-C6-Alkylsulfinyl-C1-C6-alkyl, C1-C6-Alkylsulfonyl-C1-C6-alkyl, C1-C4-Alkoxy-C1-C4-alkoxy-C1-C4-alkyl, C1-C6-Alkoxycarbonyl-C1-C6-alkyl, C1-C3-Alkoxy-C1-C3-alkoxycarbonyl-C1-C6-alkyl, C2-C4-Alkenyloxy-C1-C4-alkyl, C3-C4-Alkinyloxy-C1-C4-alkyl, C3-C7-Cycloalkyl, C3-C7-Cycloalkyl-C1-C6-alkyl, C3-C7-Cycloalkyloxy-C1-C6-alkyl, C3-C7-Cycloalkylthio-C1-C6-alkyl, C3-C8-Alkenyl, C3-C8-Alkinyl, C3-C8-Halogenalkenyl, C3-C8-Halogenalkinyl, C1-C6-Alkoxy-C3-C8-alkenyl, C1-C6-alkoxy-C3-C8-alkinyl, C1-C6-Alkylcarbonyl, C1-C6-Alkylsulfonyl, C3-C6-Alkenyloxy, C3-C6-Alkinyloxy oder geg. subst. Benzyl; X = -O-, -S-, -NH-, -N(CH3)-, -CH2-; Y = chemische Bindung, -CO-, C(R5,R6); R5,R6 = H, NO2, CN, OCH3, SCH3, Halogen, C1-C4-Alkyl, C1-C4-Halogenalkyl, C1-C4-Alkoxycarbonyl, C2-C6-Alkenyl, C3-C6-Alkinyl, C1-C4-Alkoxycarbonyl-C1-C4-alkyl. Verwendung: als Herbizide; zur Desikkation/Defoliation von Pflanzen.(EN) Substituted 2-arylpyridine of formula (I) and salts thereof. In said formula (I), R1 = SH, SO2OH, SO2C1, SO2NH2, C1-C6-Alkylthio, C1-C6-Alkyl sulfinyl, C1-C6-alkylsulfonyl, C1-C6-alkylamino-sulfonyl, Di(C1-C6-alkyl)aminosulfonyl; R2, R3 = H, halogen; R4 = H, C1-C6-alkyl, C1-C6-halogenalkyl, cyano-C1-C6-alkyl, C1-C6-alkoxy, C1-C6-alkoxy-C1-C6-alkyl, C1-C4-halogen-alkoxy-C1-C4-alkyl, C1-C6-alkylthio-C1-C6-alkyl, C1-C6 alkyl sulfinyl-C1-C6-alkyl, C1-C6-alkylsulfonyl-C1-C6-alkyl, C1-C4-alkoxy-C1-C4-alkoxy-C1-C4-alkyl, C1-C6-alkoxycarbonyl-C1-C6-alkyl, C1-C3-alkoxy-C1-C3-alkoxycarbonyl-C1-C6-alkyl, C2-C4-alkenyloxy-C1-C4-alkyl, C3-C4-alkinyloxy-C1-C4-alkyl, C3-C7-cycloalkyl, C3-C7-cycloalkyl-C1-C6-alkyl, C3-C7-cycloalkyloxy-C1-C6-alkyl, C3-C7-cycloalkylthio-C1-C6-alkyl, C3-C8-alkenyl, C3-C8-alkinyl, C3-C8-halogenalkenyl, C3-C8-halogenalkinyl, C1-C6-alkoxy-C3-C8-alkenyl, C1-C6-alkoxy-C3-C8-alkinyl, C1-C6-alkylcarbonyl, C1-C6-alkylsulfonyl, C3-C6-alkenyloxy, C3-C6-alkinyloxy or eventually substituted benzyl; X = -O-, -S-, -NH-, -N(CH3)-, -CH2-; Y = chemical bond, -CO-, C(R5,R6); R5,R6 = H, NO2, CN, OCH3, SCH3, halogen, C1-C4-alkyl, C1-C4-halogenalkyl, C1-C4-alkoxycarbonyl, C2-C6-alkenyl, C3-C6-alkinyl, C1-C4-alkoxycarbonyl-C1-C4-alkyl. Application as herbicide; for plant desiccation/defoliation.(FR) Arylpyridine substituée en 2 répondant à la formule (I) et ses sels. Dans ladite formule (I), R1 = SH, SO2OH, SO2C1, SO2NH2, C1-C6-Alkylthio, C1-C6-Alkyle sulfinyle, C1-C6-alkylsulfonyle, C1-C6-alkylamino-sulfonyle, Di(C1-C6-alkyl)aminosulfonyle; R2, R3 = H, halogène; R4 = H, C1-C6-alkyle, C1-C6-halogenalkyle, cyano-C1-C6-alkyle, C1-C6-alkoxy, C1-C6-alkoxy-C1-C6-alkyle, C1-C4-halogène-alkoxy-C1-C4-alkyle, C1-C6-alkylthio-C1-C6-alkyle-, C1-C6-alkylsulfinyle-C1-C6-alkyle, C1-C6-alkylsulfonyl-C1-C6 alkyle, C1-C4-alkoxy-C1-C4-alkoxy-C1-C4-alkyle, C1-C6-alkoxycarbonyle-C1-C6-alkyle, C1-C3-alkoxy-C1-C3-alkoxycarbonyl-C1-C6-alkyle, C2-C4-alkenyloxy-C1-C4-alkyle, C3-C4-alkinyloxy-C1-C4-alkyle, C3-C7-cycloalkyle, C3-C7-cycloalkyl-C1-C6-alkyle, C3-C7-cycloalkyloxy-C1-C6-alkyle, C3-C7-cycloalkylthio-C1-C6-alkyle, C3-C8-alkenyle, C3-C8-alkinyle, C3-C8-halogenalkenyle, C3-C8-halogenalkinyle, C1-C6-alkoxy-C3-C8-alkenyle, C1-C6-alkoxy-C3-C8-alkinyle, C1-C6-alkylcarbonyle, C1-C6-alkylsulfonyle, C3-C6-alkenyloxy, C3-C6-alkinyloxy ou benzyl éventuellement substitué; X = -O-, -S-, -NH-, -N(CH3)-, -CH2-; Y = liaison chimique, -CO-, C(R5,R6); R5,R6 = H, NO2, CN, OCH3, SCH3, halogène, C1-C4-alkyle, C1-C4-halogenalkyle, C1-C4-alkoxycarbonyle, C2-C6-alkenyle, C3-C6-alkinyle, C1-C4-alkoxycarbonyl-C1-C4-alkyle. Application: comme herbicide; pour la dessication/défoliation des plantes.
    ( DE ) Substituierte 2-Arylpyridine ( I ) und deren Salze , wobei R1 = SH , SO2OH , SO2C1 , SO2NH2 , C1-C6-Alkylthio , C1-C6-Alkylsulfinyl , C1-C6-Alkylsulfonyl , C1-C6-Alkylaminosulfonyl , Di(C1-C6-alkyl)aminosulfonyl ; R2 , R3 = H , Halogen ; R4 = H , C1-C6-Alkyl , C1-C6-Halogenalkyl , Cyano-C1-C6-alkyl , C1-C6-Alkoxy , C1-C6-Alkoxy-C1-C6-alkyl , C1-C4-Halogenalkoxy-C1-C4-alkyl , C1-C6-Alkylthio-C1-C6-alkyl , C1-C6-Alkylsulfinyl-C1-C6-alkyl , C1-C6-Alkylsulfonyl-C1-C6-alkyl , C1-C4-Alkoxy-C1-C4-alkoxy-C1-C4-alkyl , C1-C6-Alkoxycarbonyl-C1-C6-alkyl , C1-C3-Alkoxy-C1-C3-alkoxycarbonyl-C1-C6-alkyl , C2-C4-Alkenyloxy-C1-C4-alkyl , C3-C4-Alkinyloxy-C1-C4-alkyl , C3-C7-Cycloalkyl , C3-C7-Cycloalkyl-C1-C6-alkyl , C3-C7-Cycloalkyloxy-C1-C6-alkyl , C3-C7-Cycloalkylthio-C1-C6-alkyl , C3-C8-Alkenyl , C3-C8-Alkinyl , C3-C8-Halogenalkenyl , C3-C8-Halogenalkinyl , C1-C6-Alkoxy-C3-C8-Alkenyl , C1-C6-Alkoxy-C3-C8-Alkinyl , C1-C6-Alkylcarbonyl , C1-C6-Alkylsulfonyl , C3-C6-Alkenyloxy , C3-C6-Alkinyloxy oder geg. substit. Benzyl ; X = -O- , -S- , -NH- , -N(CH3)- , -CH2- ; Y = chemische Bindung , -CO- , C(R5,R6) ; R5,R6 = H , NO2 , CN , OCH3 , SCH3 , Halogen , C1-C4-Alkyl , C1-C4-Halogenalkyl , C1-C4-Alkoxycarbonyl , C2-C6-Alkenyl , C3-C6-Alkinyl , C1-C4-Alkoxycarbonyl-C1-C4-alkyl. Benutzung: als Herbicide ; zur Entsechung/Ent.Decimalisierung von Pflanzen. ( EN ) Substituted 2-arylpyridine of formula ( I ) and its salts. In formula ( I ), R1 = SH , SO2OH , SO2C1 , SO2NH2 , C1-C6-alkylthio , C1-C6-alkyl sulfinyl , C1-C6-alkylsulfonyl , C1-C6-alkylaminosulfonyl , Di(C1-C6-alkyl)aminosulfonyl ; R2 , R3 = H , halogen ; R4 = H , C1-C6-alkyl , C1-C6-halogenalkyl , cyano-C1-C6-alkyl , C1-C6-alkoxy , C1-C6-alkoxy-C1-C6-alkyl , C1-C4-halogen-alkoxy-C1-C4-alkyl , C1-C6-alkylthio-C1-C6-alkyl , C1-C6-alkylsulfinyl-C1-C6-alkyl , C1-C6-alkylsulfonyl-C1-C6-alkyl , C1-C4-alkoxy-C1-C4-alkoxy-C1-C4-alkyl , C1-C6-alkoxycarbonyl-C1-C6-alkyl , C1-C3-alkoxy-C1-C3-alkoxycarbonyl-C1-C6-alkyl , C2-C4-alkenyloxy-C1-C4-alkyl , C3-C4-alkinyloxy-C1-C4-alkyl , C3-C7-cycloalkyl , C3-C7-cycloalkyl-C1-C6-alkyl , C3-C7-cycloalkyloxy-C1-C6-alkyl , C3-C7-cycloalkylthio-C1-C6-alkyl , C3-C8-alkenyl , C3-C8-alkinyl , C3-C8-halogenalkenyl , C3-C8-halogenalkinyl , 1-C6-alkoxy-C3-C8-alkenyl , 1-C6-alkoxy-C3-C8-alkinyl , 1-C6-alkylcarbonyle , 1-C6-alkylsulfonyl , C3-C6-alkenyloxy , C3-C6-alkinyloxy or eventually substitute benzyl ; X = -O- , -S- , -NH- , -N(CH3)- , -CH2- ; Y = chemical bond , -CO- , C(R5,R6) ; R5,R6 = H , NO2 , CN , OCH3 , SCH3 , halogen , C1-C4-alkyl , C1-C4-halogenalkyl , C1-C4-alkoxycarbonyl , C2-C6-alkenyl , C3-C6-alkinyl , C1-C4-alkoxycarbonyl-C1-C4-alkyl. Application: as herbicide ; for plant desiccation/defoliation.
  • US6448205B1
    申请人:——
    公开号:US6448205B1
    公开(公告)日:2002-09-10
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