1-(4-chlorophenyl)-2-(cyclopentylmethyl)-9-ethyl-1H-purin-6(9H)-one | 1188383-97-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 1-(4-chlorophenyl)-2-(cyclopentylmethyl)-9-ethyl-1H-purin-6(9H)-one
• 英文别名: 1-(4-Chlorophenyl)-2-(cyclopentylmethyl)-9-ethylpurin-6-one
• CAS: 1188383-97-2
• 化学式: C₁₉H₂₁ClN₄O
• 分子量: 356.855
• InChiKey: GRHBGNSVQYGFOH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  50.5
• 氢给体数：
  0
• 氢受体数：
  3

文献信息

• [EN] SUBSTITUTED ARYL PYRIMIDINONE DERIVATIVES<br/>[FR] DÉRIVÉS D'ARYLPYRIMIDONE SUBSTITUÉS
  申请人：NEUROGEN CORP

  公开号：WO2009121036A2

  公开（公告）日：2009-10-01

  Substituted aryl pyrimidinone derivatives are provided, of the Formula: wherein variables are as described herein. Such compounds are ligands that may be used to modulate specific receptor activity in vivo or in vitro, and are particularly useful in the treatment of conditions associated with pathological receptor activation in humans, domesticated companion animals and livestock animals. Pharmaceutical compositions and methods for using such compounds to treat such disorders are provided, as are methods for using such ligands for receptor localization studies.