3-[(2S)-2-[[1-(1-azabicyclo[2.2.0]hexan-4-yl)benzimidazol-2-yl]methyl]pyrrolidin-1-yl]propanoic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: 3-[(2S)-2-[[1-(1-azabicyclo[2.2.0]hexan-4-yl)benzimidazol-2-yl]methyl]pyrrolidin-1-yl]propanoic acid
• 化学式: C₂₀H₂₆N₄O₂
• 分子量: 354.4
• InChiKey: PSACMMOIFKVSJC-HNNXBMFYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.3
• 重原子数：
  26
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  61.6
• 氢给体数：
  1
• 氢受体数：
  5

文献信息

• [EN] SUBSTITUTED BENZIMIDAZOLE-TYPE PIPERIDINE COMPOUNDS AND USES THEREOF<br/>[FR] COMPOSÉS DE PIPÉRIDINE DE TYPE BENZIMIDAZOLE SUBSTITUÉ ET LEURS UTILISATIONS
  申请人：PURDUE PHARMA LP

  公开号：WO2014102594A2

  公开（公告）日：2014-07-03

  The disclosure relates to Substituted Benzimidazole-Type Piperidine Compounds of Formula (I) and pharmaceutically acceptable salts or solvates thereof, e.g., a pharmaceutically acceptable salt or solvate, wherein R1, R2, R3, Qa, W, U, A, B, Z, a, and the dashed lines are as defined herein, compositions comprising an effective amount of a Substituted Benzimidazole-Type Piperidine Compound, and methods to treat or prevent a condition, such as pain, comprising administering to an animal in need thereof an effective amount of a Substituted Benzimidazole-Type Piperidine Compound.