4-[6-[4-[[4-(3-Chloro-5-methylhexa-1,3,5-trien-2-yl)-5-methyl-3,4,9,11-tetrazatricyclo[8.4.0.02,6]tetradeca-1(10),2,5,11,13-pentaen-9-yl]sulfonyl]phenyl]-3,4-dimethylhexa-1,3-dien-2-yl]-5-methyl-9-(4-methylphenyl)sulfonyl-3,4,9,11-tetrazatricyclo[8.4.0.02,6]tetradeca-1(10),2,5,11,13-pentaene

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4-[6-[4-[[4-(3-Chloro-5-methylhexa-1,3,5-trien-2-yl)-5-methyl-3,4,9,11-tetrazatricyclo[8.4.0.02,6]tetradeca-1(10),2,5,11,13-pentaen-9-yl]sulfonyl]phenyl]-3,4-dimethylhexa-1,3-dien-2-yl]-5-methyl-9-(4-methylphenyl)sulfonyl-3,4,9,11-tetrazatricyclo[8.4.0.02,6]tetradeca-1(10),2,5,11,13-pentaene
• 英文别名: 4-[6-[4-[[4-(3-chloro-5-methylhexa-1,3,5-trien-2-yl)-5-methyl-3,4,9,11-tetrazatricyclo[8.4.0.02,6]tetradeca-1(10),2,5,11,13-pentaen-9-yl]sulfonyl]phenyl]-3,4-dimethylhexa-1,3-dien-2-yl]-5-methyl-9-(4-methylphenyl)sulfonyl-3,4,9,11-tetrazatricyclo[8.4.0.02,6]tetradeca-1(10),2,5,11,13-pentaene
• 化学式: C₅₀H₅₁ClN₈O₄S₂
• 分子量: 927.6
• InChiKey: CFUJUJSCANSBCS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.8
• 重原子数：
  65
• 可旋转键数：
  12
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.24
• 拓扑面积：
  153
• 氢给体数：
  0
• 氢受体数：
  10