9-Chloro-2,2-dimethyl-5-(quinolin-3-yl)-2,3-dihydrobenzo[f] [1,4]oxazepine | 1207749-52-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: 9-Chloro-2,2-dimethyl-5-(quinolin-3-yl)-2,3-dihydrobenzo[f] [1,4]oxazepine
• 英文别名: 9-chloro-2,2-dimethyl-5-quinolin-3-yl-3H-1,4-benzoxazepine
• CAS: 1207749-52-7
• 化学式: C₂₀H₁₇ClN₂O
• 分子量: 336.821
• InChiKey: HNLJDDMJVLOQOA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.5
• 重原子数：
  24
• 可旋转键数：
  1
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  34.5
• 氢给体数：
  0
• 氢受体数：
  3

文献信息

• NITROGEN-CONTAINING HETEROCYCLIC DERIVATIVE AND FUNGICIDE FOR AGRICULTURAL AND HORTICULTURAL USE
  申请人：Mitani Akira

  公开号：US20110136782A1

  公开（公告）日：2011-06-09

  The present invention provides a nitrogen-containing heterocyclic compound represented by formula (I) and salt thereof (wherein, R 1 to R 6 each independently represents a hydrogen atom, unsubstituted or substituted C1-20 alkyl group and the like, R 1 and R 2 , R 3 and R 4 , or R 5 and R 6 may together form an unsubstituted or substituted 5- to 8-membered ring, A-B, in which A represents a carbon atom and B represents a nitrogen atom, represents the formula: C═N and the like, Y represents an oxygen atom and the like, X and X′ each independently represent an unsubstituted or substituted C1-20 alkyl group and the like, m represents an integer of 0 to 2, and n represents an integer of 0 to 4), and a fungicide for agricultural and horticultural use that contains at least one of these compounds as an active ingredient thereof, demonstrates reliable effects and can be used safely. The present invention further provides a boronic acid derivative that is a production intermediate of the aforementioned compounds, and a production method thereof.

  本发明提供了一种含氮杂环化合物及其盐，其化学式为(I)，其中，R1至R6各自独立地表示氢原子，未取代或取代的C1-20烷基等，R1和R2、R3和R4，或R5和R6可以共同形成未取代或取代的5-至8元环A-B，其中A表示碳原子，B表示氮原子，表示C═N等，Y表示氧原子等，X和X'各自独立地表示未取代或取代的C1-20烷基等，m表示0至2的整数，n表示0至4的整数。本发明还提供了一种杀菌剂，用于农业和园艺，其含有至少其中一种化合物作为其活性成分，具有可靠的效果并可以安全使用。本发明还提供了一种硼酸衍生物，它是上述化合物的生产中间体，以及其生产方法。
• AGRICULTURAL AND HORTICULTURAL GERMICIDE COMPOSITION
  申请人：Nippon Soda Co., Ltd.

  公开号：EP3760044A1

  公开（公告）日：2021-01-06

  It is an object of the present invention to provide an agricultural and horticultural fungicide composition that exhibits an excellent control effect on plant diseases even in a small dose and causes no fear of phytotoxicity to useful plants. The agricultural and horticultural fungicide composition of the present invention comprises at least one compound A selected from the group consisting of a compound of formula (1) wherein each X independently is a halogeno group or a C1-6 alkyl group; n is the number of X and is any integer of 0 to 5; X' is a halogeno group; R1, R2 and R3 each independently are a C1-6 alkyl group, a C1-6 alkoxy group or a hydroxyl group; and A1 and A2 each independently are a nitrogen atom or a carbon atom}, and the like, and at least one compound B selected from the group consisting of silthiofam, an antibiotic, propineb and chinomethionat.

  本发明的目的是提供一种农业和园艺杀真菌剂组合物，该组合物即使在小剂量下也能对植物病害表现出极佳的防治效果，并且不用担心对有用植物产生植物毒性。本发明的农业和园艺杀真菌剂组合物包括至少一种选自由式（1）其中每个 X 独立地为卤代基团或 C1-6 烷基；n 为 X 的数目，为 0 至 5 的任意整数；X'为卤代基团；R1、R2 和 R3 各自独立地为一个 C1-6 烷基、一个 C1-6 烷氧基或一个羟基；以及 A1 和 A2 各自独立地为一个氮原子或一个碳原子}等，以及至少一种选自硅噻吩、抗生素、丙氨酚和喹莫特的化合物 B。
• NITROGENATED HETEROCYCLIC DERIVATIVE, AND AGRICULTURAL OR HORTICULTURAL BACTERICIDAL AGENT
  申请人：Nippon Soda Co., Ltd.

  公开号：EP2314583B1

  公开（公告）日：2015-02-25
• AGRICULTURAL AND HORTICULTURAL FUNGICIDE COMPOSITION
  申请人：Nippon Soda Co., Ltd.

  公开号：US20200352168A1

  公开（公告）日：2020-11-12

  It is an object of the present invention to provide an agricultural and horticultural fungicide composition that exhibits an excellent control effect on plant diseases even in a small dose and causes no fear of phytotoxicity to useful plants. The agricultural and horticultural fungicide composition of the present invention comprises at least one compound A selected from the group consisting of a compound of formula (1) wherein each X independently is a halogeno group or a C1-6 alkyl group; n is the number of X and is any integer of 0 to 5; X′ is a halogeno group; R 1 , R 2 and R 3 each independently are a C1-6 alkyl group, a C1-6 alkoxy group or a hydroxyl group; and A 1 and A 2 each independently are a nitrogen atom or a carbon atom}, and the like, and at least one compound B selected from the group consisting of silthiofam, an antibiotic, propineb and chinomethionat.
• US8557738B2
  申请人：——

  公开号：US8557738B2

  公开（公告）日：2013-10-15