4-[5-(3,5-dichloro-4-fluorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-methyl-N-((R)-2-ethyl-3-oxoisoxazolidin-4-yl)benzamide | 1309958-03-9

• 分子结构分类: 有机化合物 - 有机酸及其衍生物 - 羧酸及其衍生物
• 英文名称: 4-[5-(3,5-dichloro-4-fluorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-methyl-N-((R)-2-ethyl-3-oxoisoxazolidin-4-yl)benzamide
• 英文别名: Isocycloseram, (4R,5R)-；4-[(5R)-5-(3,5-dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4H-1,2-oxazol-3-yl]-N-[(4R)-2-ethyl-3-oxo-1,2-oxazolidin-4-yl]-2-methylbenzamide
• CAS: 1309958-03-9
• 化学式: C₂₃H₁₉Cl₂F₄N₃O₄
• 分子量: 548.321
• InChiKey: WLSQDEYDCAGPIR-XMSQKQJNSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  36
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  80.2
• 氢给体数：
  1
• 氢受体数：
  9

反应信息

• 作为产物：
  描述：

  4-[5-(3,5-dichloro-4-fluorophenyl)-5-(trifluoromethyl)-4H-isoxazol-3-yl]-N-[(4R)-2-ethyl-3-oxoisoxazolidin-4-yl]-2-methylbenzamide 在 Chiralpak IB 作用下， 生成 4-[5-(3,5-dichloro-4-fluorophenyl)-5-trifluoromethyl-4,5-dihydroisoxazol-3-yl]-2-methyl-N-((R)-2-ethyl-3-oxoisoxazolidin-4-yl)benzamide 、 isocycloseram
  参考文献：
  名称：

  [EN] INSECTICIDAL COMPOUNDS BASED ON ISOXAZOLINE DERIVATIVES
  [FR] COMPOSÉS INSECTICIDES À BASE DE DÉRIVÉS ISOXAZOLINE

  摘要：

  本发明涉及式(I)的化合物：其中A1、A2、A3、A4、G1、L、Y1、Y2、Y3、Y4、R1、R2、R3和R4如权利要求1所定义；或其盐或N-氧化物。此外，本发明涉及制备式(I)化合物的中间体，包含它们的组合物以及使用它们来对抗和控制昆虫、螨虫、线虫和软体动物害虫的方法。

  公开号：

  WO2011067272A1

文献信息

• [EN] PROCESS FOR THE PREPARATION OF OPTICALLY ACTIVE ISOXAZOLINE COMPOUNDS<br/>[FR] PROCÉDÉ DE PRÉPARATION DE COMPOSÉS ISOXAZOLINE OPTIQUEMENT ACTIFS
  申请人：SYNGENTA PARTICIPATIONS AG

  公开号：WO2016023787A1

  公开（公告）日：2016-02-18

  The present invention relates to a process for the preparation of a compound of formula (I) wherein A1 and A2 are C-H, or one of A1 and A2 is C-H and the other is N; R1 is C1-C4alkyl, C1-C4haloalkyl or C3-C6cycloalkyl; each R2 is independently bromo, chloro, fluoro or trifluoromethyl; R3 is hydrogen; R4 is hydrogen, halogen, methyl, halomethyl or cyano; or R3 and R4 together form a bridging 1,3-butadiene group; R5 is chlorodifluoromethyl or trifluoromethyl; n is 2 or 3; by reacting a compound of formula (II) wherein A1, A2, R1, R2, R3, R4, R5 and n is as defined under formula (I) above, with hydroxylamine, a base and a chiral catalyst, characterized in that the chiral catalyst is a dimeric chiral catalyst of formula (III) wherein R6, R7, R8, R9, R10 and X are as defined in claim 1.

  本发明涉及一种制备式（I）化合物的方法，其中A1和A2是C-H，或者A1和A2中的一个是C-H，另一个是N；R1是C1-C4烷基，C1-C4卤代烷基或C3-C6环烷基；每个R2独立地是溴、氯、氟或三氟甲基；R3是氢；R4是氢、卤素、甲基、卤代甲基或氰基；或者R3和R4一起形成桥接的1,3-丁二烯基团；R5是氯二氟甲基或三氟甲基；n为2或3；通过将式（II）化合物与羟胺、碱和手性催化剂反应，其中A1、A2、R1、R2、R3、R4、R5和n如上述式（I）所定义，其特征在于手性催化剂是式（III）的二聚手性催化剂，其中R6、R7、R8、R9、R10和X如权利要求1所定义。
• Pesticidally activi mixtures comprising anthranilamide compounds
  申请人：BASF SE

  公开号：US11297837B2

  公开（公告）日：2022-04-12

  Pesticidal mixtures including a pesticidally active anthranilamide compound of formula (I) and at least one further pesticidal active ingredient. The pesticidal mixtures are useful for combating and controlling insects, acarids or nematodes in and on plants, and for protecting such plants being infested with pests.

  杀虫混合物，包括具有杀虫活性的式(I)蒽酰胺化合物 和至少另一种杀虫活性成分。杀虫混合物可用于防治植物体内和植物上的昆虫、寄生虫或线虫，以及保护被害虫侵扰的植物。
• Pesticidally active mixtures
  申请人：BASF Agrochemical Products B.V.

  公开号：US11330820B2

  公开（公告）日：2022-05-17

  Pesticidal mixtures including a pesticidally active compound I selected from: a) compound a) of formula (I). b) compound b) of formula (Ia), c) mixtures comprising compounds a) and b), and at least one further pesticidal active ingredient are disclosed. Methods and use of these mixtures for combating and controlling insects, acarids or nematodes in and on plants, and for protecting such plants being infested with pests are disclosed.

  杀虫混合物，包括选自下列各项的杀虫活性化合物 I： 1： a) 式(I)化合物a)。 b) 式 (Ia) 的化合物 b)、 c) 由化合物 a) 和 b) 组成的混合物、 和至少一种杀虫活性成分的混合物。本发明公开了这些混合物用于防治植物体内和植物上的昆虫、寄生虫或线虫，以及保护受害虫侵扰的植物的方法和用途。
• INSECTICIDAL FORMULATION FOR VECTOR AND PEST CONTROL WITH INCREASED CONTACT EFFICACY
  申请人：Bayer Aktiengesellschaft

  公开号：EP3897131A1

  公开（公告）日：2021-10-27
• PESTICIDALLY ACTIVE MIXTURES
  申请人：BASF Agrochemical Products B.V.

  公开号：US20190230926A1

  公开（公告）日：2019-08-01

  Pesticidal mixtures including a pesticidally active compound I selected from: a) compound a) of formula (I). b) compound b) of formula (Ia), c) mixtures comprising compounds a) and b), and at least one further pesticidal active ingredient are disclosed. Methods and use of these mixtures for combating and controlling insects, acarids or nematodes in and on plants, and for protecting such plants being infested with pests are disclosed.