(7Z)-3-{[[2-(4-fluorophenyl)-2-hydroxyethyl](methyl)amino]-sulfonyl}-7-[({[3,4-(methylenedioxy)anilino]carbonyl}oxy)imino]-4,5,6,7-tetrahydro-1-benzothiophene | 864960-04-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并间二氧杂环戊烯类
• 英文名称: (7Z)-3-{[[2-(4-fluorophenyl)-2-hydroxyethyl](methyl)amino]-sulfonyl}-7-[({[3,4-(methylenedioxy)anilino]carbonyl}oxy)imino]-4,5,6,7-tetrahydro-1-benzothiophene
• 英文别名: [(Z)-[3-[[2-(4-fluorophenyl)-2-hydroxyethyl]-methylsulfamoyl]-5,6-dihydro-4H-1-benzothiophen-7-ylidene]amino] N-(1,3-benzodioxol-5-yl)carbamate
• CAS: 864960-04-3
• 化学式: C₂₅H₂₄FN₃O₇S₂
• 分子量: 561.612
• InChiKey: WZXIJJSSYOKJDL-USHMODERSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.7
• 重原子数：
  38
• 可旋转键数：
  8
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.28
• 拓扑面积：
  163
• 氢给体数：
  2
• 氢受体数：
  11

文献信息

• Heterocyclic compound having oxime group
  申请人：Yoshida Ichiro

  公开号：US20050227959A1

  公开（公告）日：2005-10-13

  The present invention provides a compound that has an excellent inhibitory activity on STAT6 activation and is effective against allergic diseases, and a medicinal composition thereof. According to the present invention, disclosed is the compound represented by the General Formula (I) [where R 1 and R 2 independently represent a C 1-6 alkyl group and the like that may have a hydrogen atom or a substituent; R 3 represents a C 1-6 alkyl group and the like that may have a substituent; R 4 and R 5 independent represents a hydrogen atom or a C 1-6 alkyl group and the like that may have a substituent; R 6 represents a hydrogen atom and the like; W represents —SO 2 — and the like; and X represents a sulphur atom and the like.]or a salt thereof, or a hydrate thereof.

  本发明提供了一种对STAT6激活具有优异抑制活性且对过敏疾病有效的化合物及其药物组合物。根据本发明，公开了由通式（I）表示的化合物[其中R1和R2独立地表示可能具有氢原子或取代基等的C1-6烷基基团；R3表示可能具有取代基的C1-6烷基基团等；R4和R5独立地表示可能具有取代基的氢原子或C1-6烷基基团等；R6表示氢原子等；W表示—SO2—等；X表示硫原子等]或其盐或水合物。
• US7217723B2
  申请人：——

  公开号：US7217723B2

  公开（公告）日：2007-05-15