[4-[[6-Chloro-5-[5-ethyl-6-[3-[[5-(5-ethylfuro[2,3-c]pyridin-2-yl)-6-methyl-2-(2,2,2-trifluoroethylamino)pyrimidin-4-yl]amino]-5-(hydroxymethyl)-2-methylcyclopentyl]furo[2,3-c]pyridin-6-ium-2-yl]-2-(2-methylpropylamino)pyrimidin-4-yl]amino]-2,3-dimethylcyclopentyl]methanol

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 呋喃吡啶类
• 英文名称: [4-[[6-Chloro-5-[5-ethyl-6-[3-[[5-(5-ethylfuro[2,3-c]pyridin-2-yl)-6-methyl-2-(2,2,2-trifluoroethylamino)pyrimidin-4-yl]amino]-5-(hydroxymethyl)-2-methylcyclopentyl]furo[2,3-c]pyridin-6-ium-2-yl]-2-(2-methylpropylamino)pyrimidin-4-yl]amino]-2,3-dimethylcyclopentyl]methanol
• 英文别名: [4-[[6-chloro-5-[5-ethyl-6-[3-[[5-(5-ethylfuro[2,3-c]pyridin-2-yl)-6-methyl-2-(2,2,2-trifluoroethylamino)pyrimidin-4-yl]amino]-5-(hydroxymethyl)-2-methylcyclopentyl]furo[2,3-c]pyridin-6-ium-2-yl]-2-(2-methylpropylamino)pyrimidin-4-yl]amino]-2,3-dimethylcyclopentyl]methanol
• 化学式: C48H61ClF3N10O4+
• 分子量: 934.5
• InChiKey: HPJNACPSYNJTDZ-UHFFFAOYSA-O

计算性质

• 辛醇/水分配系数(LogP)：
  10.9
• 重原子数：
  66
• 可旋转键数：
  16
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  183
• 氢给体数：
  6
• 氢受体数：
  16