N-(4'-chloro-3'-fluoro-1,1'-biphenyl-2-yl)-4-(difluoromethyl)-2-methyl-1,3-thiazole-5-carboxamide | 577954-96-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-(4'-chloro-3'-fluoro-1,1'-biphenyl-2-yl)-4-(difluoromethyl)-2-methyl-1,3-thiazole-5-carboxamide
• 英文别名: N-(4'-chloro-3'-fluorobiphenyl-2-yl)-4-difluoromethyl-2-methylthiazole-5-carboxamide；N-(4'-chloro-3'-fluoro-1,1'-biphenyl-2-yl)-2-methyl-4-(difluoromethyl)-1,3-thiazole-5-carboxamide；N-[2-(4-chloro-3-fluorophenyl)phenyl]-4-(difluoromethyl)-2-methyl-1,3-thiazole-5-carboxamide
• CAS: 577954-96-2
• 化学式: C₁₈H₁₂ClF₃N₂OS
• 分子量: 396.82
• InChiKey: AYVPXJFRSYHRJX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.5
• 重原子数：
  26
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.11
• 拓扑面积：
  70.2
• 氢给体数：
  1
• 氢受体数：
  6

文献信息

• Azolylmethyloxiranes, Their Use for Controlling Phytopathogenic Fungi and Compositions Comprising Them
  申请人：Dietz Jochen

  公开号：US20100167924A1

  公开（公告）日：2010-07-01

  The present invention relates to azolylmethyloxiranes of the general formula I in which A is phenyl which is substituted by three F, B is unsubstituted pyridyl, thienyl, thiazolyl, oxazolyl or furyl or is phenyl which is substituted by one to three of the following substituents: halogen, NO 2 , amino, C 1 -C 4 -alkyl, C 1 -C 4 -alkoxy, C 1 -C 4 -haloalkyl, C 1 -C 4 -haloalkoxy, C 1 -C 4 alkylamino, C 1 -C 4 -dialkylamino, thio or C 1 -C 4 -alkylthio, and to the plant-compatible acid addition salts or metal salts thereof, to the use of the compounds of the formula I for controlling phytopathogenic fungi and to compositions comprising these compounds.

  本发明涉及通式I的咪唑基氧环丙烷，其中A为被三个F取代的苯基，B为未取代的吡啶基、噻吩基、噻唑基、噁唑基或呋喃基，或者为被以下一到三种取代基取代的苯基：卤素、NO2、氨基、C1-C4烷基、C1-C4烷氧基、C1-C4卤代烷基、C1-C4卤代烷氧基、C1-C4烷基氨基、C1-C4二烷基氨基、硫醚或C1-C4烷基硫醚，以及该化合物的植物相容性酸盐或金属盐，以及用于控制植物病原真菌的通式I化合物的用途和包含这些化合物的组合物。
• Azolylmethyloxiranes, Their Use for Controlling Phytopathogenic Fungi, and Compositions Comprising Them
  申请人：Dietz Jochen

  公开号：US20100179058A1

  公开（公告）日：2010-07-15

  The present invention relates to azolylmethyloxiranes of the general formula I in which A is phenyl which is substituted by two F, B is unsubstituted pyridyl, thienyl, thiazolyl, oxazolyl or furyl or is phenyl which is optionally substituted by one to three of the following substituents: halogen, NO 2 , amino, C 1 -C 4 -alkyl, C 1 -C 4 alkoxy, C 1 -C 4 -haloalkyl, C 1 -C 4 -haloalkoxy, C 1 -C 4 -alkylamino, thio or C 1 -C 4 -alkylthio, with the proviso that B is not o-methylphenyl if A is 2,4-difluorophenyl, and to the plant-compatible acid addition salts or metal salts thereof, to the use of the compounds of the formula I for controlling phytopathogenic fungi and to compositions comprising these compounds.

  本发明涉及一般式I的氮杂环氧环丙烷，其中A为被两个F取代的苯基，B为未取代的吡啶基、噻吩基、噻唑基、噁唑基或呋喃基，或者为苯基，苯基可选择地被以下一到三种取代基之一取代：卤素、NO2、氨基、C1-C4烷基、C1-C4烷氧基、C1-C4卤代烷基、C1-C4卤代烷氧基、C1-C4烷基氨基、硫醚或C1-C4烷基硫醚，但若A为2,4-二氟苯基，则B不为邻甲基苯基，并涉及其与植物相容的酸盐或金属盐，以及将一般式I化合物用于控制植物病原真菌和包含这些化合物的组合物。
• 3-(Pyridin-2-Yl)-[1,2,4]-Triazines as Fungicides
  申请人：Grammenos Wassilios

  公开号：US20090111692A1

  公开（公告）日：2009-04-30

  The invention relates to 3-(pyridin-2-yl)-[1,2,4]-triazines of formula (I) and their use in the control of parasitic fungi and to herbicides that contain said compounds as an effective ingredient thereof. In formula (I), R 1 , R 2 independently represent OH, halogen, NO 2 , NH 2 , C 1 -C 8 alkyl, C 1 -C 8 alkoxy, C 1 -C 8 halogenalkyl, C 1 -C 8 halogenalkoxy, C 1 -C 8 alkylamino or di(C 1 -C 8 alkyl)amino, or they form, together with the C atoms to which they are bound, a saturated five-, six- or seven-membered carbocycle or heterocycle, which, in addition to the carbon ring members, has one or two heteroatoms selected from oxygen or sulfur as the ring members, the carbocycle and the heterocycle being unsubstituted or having 1, 2, 3 or 4 C 1 -C 4 alkyl groups as the substituents; R 3 represents hydrogen, C 1 -C 4 alkyl, C 1 -C 4 alkoxy, C 1 -C 4 halogenalkyl, C 1 -C 4 halogenalkoxy, C 3 -C 6 cycloalkyl, C 3 -C 6 cycloalkylmethyl, or halogen; R 4 represents hydrogen, C 1 -C 4 alkyl, C 1 -C 4 alkoxy, C 1 -C 4 halogenalkyl, C 1 -C 4 halogenalkoxy or halogen; R 5 represents C 1 -C 8 alkyl, C 1 -C 8 halogenalkyl, C 1 -C 8 alkoxy, C 1 -C 8 halogenalkoxy, C 3 -C 8 cycloalkyl, C 3 -C 8 cycloalkyloxy, five- or six-membered heteroaryl, phenyl, phenoxy, benzyl, benzyloxy, five- or six-membered heteroarylmethyl or five- or six-membered heteroaryloxy, said cyclic groups being unsubstituted or having 1, 2, 3, 4 or 5 groups R a .

  该发明涉及式(I)的3-(吡啶-2-基)-[1,2,4]-三嗪及其在控制寄生真菌方面的用途，以及含有该化合物作为有效成分的除草剂。在式(I)中，R1、R2独立地表示OH、卤素、NO2、NH2、C1-C8烷基、C1-C8烷氧基、C1-C8卤代烷基、C1-C8卤代烷氧基、C1-C8烷基氨基或二(C1-C8烷基)氨基，或它们与其结合的C原子一起形成饱和的五、六或七元碳环或杂环，除了碳环成员外，还有一个或两个氧或硫选择作为环成员的杂原子，碳环和杂环未被取代或具有1、2、3或4个C1-C4烷基基团；R3表示氢、C1-C4烷基、C1-C4烷氧基、C1-C4卤代烷基、C1-C4卤代烷氧基、C3-C6环烷基、C3-C6环烷基甲基或卤素；R4表示氢、C1-C4烷基、C1-C4烷氧基、C1-C4卤代烷基、C1-C4卤代烷氧基或卤素；R5表示C1-C8烷基、C1-C8卤代烷基、C1-C8烷氧基、C1-C8卤代烷氧基、C3-C8环烷基、C3-C8环烷氧基、五元或六元杂芳基、苯基、苯氧基、苄基、苄氧基、五元或六元杂芳基甲基或五元或六元杂芳氧基，所述的环基未被取代或具有1、2、3、4或5个Ra基团。
• Fungicidal Azolopyrimidines, Process for Their Preparation and Their Use For Controlling Harmful Fungi, and Also Compositions Comprising Them
  申请人：Dietz Jochen

  公开号：US20100160311A1

  公开（公告）日：2010-06-24

  The present invention relates to azolopyrimidines of the formula I in which the substituents are defined according to the description, to processes and intermediates for preparing these compounds, to compositions comprising them and to their use for controlling phytopathogenic harmful fungi.

  本发明涉及公式I的咪唑嘧啶类化合物，其中取代基根据描述进行定义，涉及制备这些化合物的方法和中间体，包括这些化合物的组合物以及它们用于控制植物病原真菌的用途。
• 6-Phenyl-7-Aminotriazolopyrimidines, Processes For Their Preparation And Their Use For Controlling Harmful Fungi, And Also Compositions Comprising Them
  申请人：Blettner Carsten

  公开号：US20070270311A1

  公开（公告）日：2007-11-22

  6-Phenyl-7-aminotriazolopyrimidines of the formula I in which the substituents are as defined below: R 1 is hydrogen, alkyl, haloalkyl, cycloalkyl, halocycloalkyl, alkenyl, haloalkenyl, cycloalkenyl, halocycloalkenyl, alkynyl, haloalkynyl or phenyl, naphthyl, or a five- or six-membered saturated, partially unsaturated or aromatic heterocycle, which comprises one to four heteroatoms from the group consisting of O, N and S, R 2 is alkyl, haloalkyl, cycloalkyl, halocycloalkyl, alkenyl, haloalkenyl, cycloalkenyl, halocycloalkenyl, alkynyl, haloalkynyl or phenyl, naphthyl, or a five- or six-membered saturated, partially unsaturated or aromatic heterocycle which comprises one to four heteroatoms from the group consisting of O, N and S, R 3 ,R 4 ,R 5 ,R 6 ,R 7 are hydrogen or one of the groups mentioned under R 2 , R 4 , together with R 3 or R 6 , may also form a five- or six-membered saturated or unsaturated ring which, in addition to carbon atoms, may comprise one to three further heteroatoms from the group consisting of O, N and S as ring members; R 2 with R 3 , R 4 with R 5 , R 6 with R 7 may in each case together, with formation of spiro groups, also form a C 2 -C 5 -alkylene, or alkenylene or alkynylene chain which may be interrupted by one to three heteroatoms from the group consisting of O, N and S; p is zero or 1; L is halogen, alkyl, haloalkyl, alkoxy, cyano, nitro, amino, alkylamino, dialkylamino, alkylcarbonylamino, C(O)—R, S(O) n —R; where n is zero, 1 or 2; R is hydrogen, alkyl, haloalkyl, alkoxy, alkenyloxy, alkynyloxy, amino, alkylamino, dialkylamino; m is 1, 2, 3, 4 or 5; X is halogen, cyano, alkyl, alkoxy, alkenyloxy, alkynyloxy or haloalkoxy; Y is oxygen or sulfur; Z is hydrogen, alkyl, haloalkyl, cycloalkyl, alkylcarbonyl, cycloalkylcarbonyl, alkenyl, haloalkenyl, cycloalkenyl, alkynyl, haloalkynyl, phenyl, naphthyl, a five- to ten-membered saturated, partially unsaturated or aromatic heterocycle which comprises one to four heteroatoms from the group consisting of O, N and S; or Z together with R 4 or R 6 may also form a five- or six-membered saturated or unsaturated ring which, in addition to carbon atoms and Y, may comprise one or two further heteroatoms from the group consisting of O, N and S as ring members the groups R 1 to R 7 , Z and R may be substituted according to the description; processes for preparing these compounds, compositions comprising them and their use for controlling phytopathogenic harmful fungi.

  化学式I中的6-苯基-7-氨基三唑吡咯啉，其中取代基定义如下：R1为氢、烷基、卤代烷基、环烷基、卤代环烷基、烯基、卤代烯基、环烯基、卤代环烯基、炔基、卤代炔基或苯基、萘基，或含有O、N和S的一至四个杂原子的五元或六元饱和、部分不饱和或芳香杂环；R2为烷基、卤代烷基、环烷基、卤代环烷基、烯基、卤代烯基、环烯基、卤代环烯基、炔基、卤代炔基或苯基、萘基，或含有O、N和S的一至四个杂原子的五元或六元饱和、部分不饱和或芳香杂环；R3、R4、R5、R6、R7为氢或R2下述提到的基之一，R4与R3或R6一起，也可形成含有O、N和S的一至三个进一步杂原子的五元或六元饱和或不饱和环；R2与R3、R4与R5、R6与R7可分别一起形成螺环，也可形成被O、N和S中的一至三个杂原子中断的C2-C5-烷基、烯基或炔基链；p为零或1；L为卤素、烷基、卤代烷基、烷氧基、氰基、硝基、氨基、烷基氨基、二烷基氨基、烷基羰基氨基、C(O)—R、S(O)n—R；其中n为零、1或2；R为氢、烷基、卤代烷基、烷氧基、烯氧基、炔氧基、氨基、烷基氨基、二烷基氨基；m为1、2、3、4或5；X为卤素、氰基、烷基、烷氧基、烯氧基、炔氧基或卤代烷氧基；Y为氧或硫；Z为氢、烷基、卤代烷基、环烷基、烷基羰基、环烷基羰基、烯基、卤代烯基、环烯基、炔基、卤代炔基、苯基、萘基，或含有O、N和S的一至四个杂原子的五至十元饱和、部分不饱和或芳香杂环；或Z与R4或R6一起，也可形成含有O、N和S的一至两个进一步杂原子的五元或六元饱和或不饱和环，其中R1至R7、Z和R的基可根据描述进行取代；制备这些化合物的方法，包括它们的组合物和用于控制植物病原真菌的用途。