[3-[3-[2-(10,10-Dimethyl-19-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,16(21),17,19-nonaen-15-yl)ethyl]phenyl]phenyl]-[3-[3-(14,14-dimethyl-6,10-diazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-10-yl)phenyl]phenyl]methanone

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二芳基庚烷
• 英文名称: [3-[3-[2-(10,10-Dimethyl-19-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,16(21),17,19-nonaen-15-yl)ethyl]phenyl]phenyl]-[3-[3-(14,14-dimethyl-6,10-diazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-10-yl)phenyl]phenyl]methanone
• 英文别名: [3-[3-[2-(10,10-dimethyl-19-azapentacyclo[11.8.0.03,11.04,9.016,21]henicosa-1,3(11),4,6,8,12,16(21),17,19-nonaen-15-yl)ethyl]phenyl]phenyl]-[3-[3-(14,14-dimethyl-6,10-diazapentacyclo[11.7.0.03,11.04,9.015,20]icosa-1(13),2,4(9),5,7,11,15,17,19-nonaen-10-yl)phenyl]phenyl]methanone
• 化学式: C₆₉H₅₃N₃O
• 分子量: 940.2
• InChiKey: YRMYKHCDEAOHFG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  16.7
• 重原子数：
  73
• 可旋转键数：
  8
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  47.8
• 氢给体数：
  0
• 氢受体数：
  3