Adamantane-1-carboxylic acid [7-(2-phenoxy-pyridine-3-carbonyl)-5,6,7,8-tetrahydro-pyrido[3,4-d]pyrimidin-4-yl]-amide | 911009-71-7

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: Adamantane-1-carboxylic acid [7-(2-phenoxy-pyridine-3-carbonyl)-5,6,7,8-tetrahydro-pyrido[3,4-d]pyrimidin-4-yl]-amide
• 英文别名: N-[7-(2-phenoxypyridine-3-carbonyl)-6,8-dihydro-5H-pyrido[3,4-d]pyrimidin-4-yl]adamantane-1-carboxamide
• CAS: 911009-71-7
• 化学式: C₃₀H₃₁N₅O₃
• 分子量: 509.608
• InChiKey: CZMINSLTBRZFAZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  38
• 可旋转键数：
  5
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  97.3
• 氢给体数：
  1
• 氢受体数：
  6

文献信息

• Bicycloheteroaryl Compounds as P2X7 Modulators and Uses Thereof
  申请人：Kelly G Michael

  公开号：US20080039478A1

  公开（公告）日：2008-02-14

  Bicycloheteroaryl compounds are disclosed that have a formula represented by the following: The compounds may be prepared as pharmaceutical compositions, and may be used for the prevention and treatment of a variety of conditions in mammals including humans, including by way of non-limiting example, pain, inflammation, traumatic injury, and others.

  本文披露了一种具有以下公式表示的Bicycloheteroaryl化合物：这些化合物可以制备为药物组成物，并可用于预防和治疗哺乳动物包括人类的各种疾病，包括但不限于疼痛，炎症，创伤性损伤等。