(+/-)-3-[5-chloro-2-[4-(trifluoromethyl)phenylmethoxy]phenyl]-1,3-dihydro-3-hydroxy-6-(trifluoromethyl)-2H-indole-2-one | 452082-72-3

• 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: (+/-)-3-[5-chloro-2-[4-(trifluoromethyl)phenylmethoxy]phenyl]-1,3-dihydro-3-hydroxy-6-(trifluoromethyl)-2H-indole-2-one
• 英文别名: (+/-)-3-[5-chloro-2-[4-(trifluoromethyl)phenyl-methoxy]phenyl]-1,3-dihydro-3-hydroxy-6-(trifluoromethyl)-2H-indole-2-one；3-[5-chloro-2-[[4-(trifluoromethyl)phenyl]methoxy]phenyl]-3-hydroxy-6-(trifluoromethyl)-1H-indol-2-one
• CAS: 452082-72-3
• 化学式: C₂₃H₁₄ClF₆NO₃
• 分子量: 501.812
• InChiKey: AISNNTHBFSKEGE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.6
• 重原子数：
  34
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  58.6
• 氢给体数：
  2
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  (+/-)-3-[5-chloro-2-[4-(trifluoromethyl)phenylmethoxy]phenyl]-1,3-dihydro-3-hydroxy-6-(trifluoromethyl)-2H-indole-2-one 在 diethylaminosulfur trifluoride 作用下， 以 二氯甲烷 为溶剂， 以77%的产率得到(+/-)-3-[5chloro-2-[4-(trifluoromethyl)phenylmethoxy]phenyl]-1,3-dihydro-3-fluoro-6-(trifluoromethyl)-2H-indole-2-one
  参考文献：
  名称：

  US6469042

  摘要：

  公开号：
• 作为产物：
  描述：

  3-(5-Chloro-2-hydroxyphenyl)-1,3-dihydro-3-hydroxy-6-(trifluoromethyl)-2H-indol-2-one 、 1-溴-三氟对二甲苯 、 potassium carbonate 在 crude product 作用下， 以 丁酮 为溶剂， 反应 48.0h， 以to afford the title compound (70 mg, 60% yield)的产率得到(+/-)-3-[5-chloro-2-[4-(trifluoromethyl)phenylmethoxy]phenyl]-1,3-dihydro-3-hydroxy-6-(trifluoromethyl)-2H-indole-2-one
  参考文献：
  名称：

  Fluoro oxindole derivatives as modulators of KCNQ potassium channels

  摘要：

  提供了一种新的式I1的3-氟-3-苯基吲哚衍生物，其中R1、R2、R3和R4各自独立地为氢、C1-4烷基、卤素、氟甲基、三氟甲基、苯基、4-甲基苯基或4-三氟甲基苯基；R5为C1-6烷基，可选地取代一到三个相同或不同的氟或氯基，但当Y为O时，R5不为C1-6烷基；Y为O或S；R6和R7各自独立地为氢、氯、溴或三氟甲基；它们是KCNQ钾通道的开放剂，可用于治疗对KCNQ钾通道开放有反应的疾病。

  公开号：

  US20020156120A1

文献信息

• Fluoro oxindole derivatives as modulators if KCNQ potassium channels
  申请人：Bristol-Myers Squibb Company

  公开号：US06469042B1

  公开（公告）日：2002-10-22

  There is provided novel 3-fluoro-3-phenyl oxindole derivatives of Formula I wherein R1, R2, R3 and R4 each are independently hydrogen, C1-4 alkyl, halogen, fluoromethyl, trifluoromethyl, phenyl, 4-methylphenyl or 4-trifluoromethylphenyl; R5 is C1-6 alkyl optionally substituted with one to three same or different groups selected from fluoro and chloro, provided R5 is not C1-6 alkyl when Y is O; Y is O or S; and R6 and R7 each are independently hydrogen, chloro, bromo or trifluoromethy; which are openers of the KCNQ potassium channels and are useful in the treatment of disorders which are responsive to the opening of the KCNQ potassium channels.

  提供了一种新型的公式I的3-氟-3-苯基氧吲哚衍生物，其中R1、R2、R3和R4各自独立地为氢、C1-4烷基、卤素、氟甲基、三氟甲基、苯基、4-甲基苯基或4-三氟甲基苯基；R5为C1-6烷基，可选地取代一到三个相同或不同的氟或氯基，当Y为O时，R5不是C1-6烷基；Y为O或S；R6和R7各自独立地为氢、氯、溴或三氟甲基。这些化合物是KCNQ钾通道的开放剂，可用于治疗对KCNQ钾通道的开放有反应的疾病。
• FLUORO OXINDOLE DERIVATIVES AS MODULATORS OF KCNQ POTASSIUM CHANNELS
  申请人：BRISTOL-MYERS SQUIBB COMPANY

  公开号：EP1363624A2

  公开（公告）日：2003-11-26
• US6469042B1
  申请人：——

  公开号：US6469042B1

  公开（公告）日：2002-10-22
• [EN] FLUORO OXINDOLE DERIVATIVES AS MODULATORS OF KCNQ POTASSIUM CHANNELS<br/>[FR] DERIVES DE FLUORO OXINDOLE EN TANT QUE MODULATEURS DE CANAUX POTASSIUM KCNQ
  申请人：BRISTOL MYERS SQUIBB CO

  公开号：WO2002066426A2

  公开（公告）日：2002-08-29

  There is provided novel 3-fluoro-3-phenyl oxindole derivatives of Formula I wherein R?1, R2, R3 and R4¿ each are independently hydrogen, C¿1-4? alkyl, halogen, fluoromethyl, trifluoromethyl, phenyl, 4-methylphenyl or 4-trifluoromethylphenyl; R?5¿ is C¿1-6? alkyl optionally substituted with one to three same or different groups selected from fluoro and chloro, provided R?5¿ is not C¿1-6? alkyl when Y is O; Y is O or S; and R?6 and R7¿ each are independently hydrogen, chloro, bromo or trifluoromethy; which are openers of the KCNQ potassium channels and are useful in the treatment of disorders which are responsive to the opening of the KCNQ potassium channels.