(3aR,4S,7aR)-methyl 4-((2-chloropyridin-4-yl)ethynyl)-4-hydroxyoctahydro-1H-indole-1-carboxylate | 1383535-62-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡咯烷类
• 英文名称: (3aR,4S,7aR)-methyl 4-((2-chloropyridin-4-yl)ethynyl)-4-hydroxyoctahydro-1H-indole-1-carboxylate
• 英文别名: methyl (3aR,4S,7aR)-4-[2-(2-chloropyridin-4-yl)ethynyl]-4-hydroxy-3,3a,5,6,7,7a-hexahydro-2H-indole-1-carboxylate
• CAS: 1383535-62-3
• 化学式: C₁₇H₁₉ClN₂O₃
• 分子量: 334.802
• InChiKey: AZEFCTGGTQYIBM-CKEIUWERSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  23
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.53
• 拓扑面积：
  62.7
• 氢给体数：
  1
• 氢受体数：
  4

文献信息

• [EN] 4- (HETERO) ARYL - ETHYNYL - OCTAHYDRO - INDOLE - 1 - CARBOXYLIC ACID ESTERS<br/>[FR] ESTERS D'ACIDES 4-(HÉTÉRO)ARYL-ÉTHYNYL-OCTAHYDRO-INDOLE-1-CARBOXYLIQUES
  申请人：NOVARTIS AG

  公开号：WO2012084873A1

  公开（公告）日：2012-06-28

  The invention relates to compound of the formula (I) or a salt thereof, wherein the substituents are as defined in the specification; to its preparation, to its use as medicament and to medicaments comprising it.

  该发明涉及公式（I）的化合物或其盐，其中取代基如规范中定义；其制备，其用作药物以及包含它的药物。
• 4-(Hetero)Aryl-Ethynyl-Octahydro-Indole-1-Esters
  申请人：Carcache David

  公开号：US20130274294A1

  公开（公告）日：2013-10-17

  The invention relates to compound of the formula (I) or a salt thereof, wherein the substituents are as defined in the specification; to its preparation, to its use as medicament and to medicaments comprising it.

  本发明涉及化合物(I)或其盐，其中取代基如规范中所定义；其制备方法；其作为药物的用途以及含有该化合物的药物。
• 4- (HETERO) ARYL - ETHYNYL - OCTAHYDRO - INDOLE - 1 - CARBOXYLIC ACID ESTERS
  申请人：Novartis AG

  公开号：EP2655326A1

  公开（公告）日：2013-10-30