12-Methyl-13-[5-(13-methyl-6,14-dioxo-3,9-dioxa-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecan-12-yl)pentyl]-3,9-dioxa-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane-6,14-dione;2,3,7,8-tetrahydropyridazino[4,5-g]phthalazine-1,4,6,9-tetrone

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: 12-Methyl-13-[5-(13-methyl-6,14-dioxo-3,9-dioxa-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecan-12-yl)pentyl]-3,9-dioxa-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane-6,14-dione;2,3,7,8-tetrahydropyridazino[4,5-g]phthalazine-1,4,6,9-tetrone
• 英文别名: 12-methyl-13-[5-(13-methyl-6,14-dioxo-3,9-dioxa-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecan-12-yl)pentyl]-3,9-dioxa-1,5,7,11-tetrazatetracyclo[9.2.1.05,13.07,12]tetradecane-6,14-dione;2,3,7,8-tetrahydropyridazino[4,5-g]phthalazine-1,4,6,9-tetrone
• 化学式: C33H38N12O12
• 分子量: 794.7
• InChiKey: QZFXTQAJCHWKOF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  -0.76
• 重原子数：
  57
• 可旋转键数：
  6
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.58
• 拓扑面积：
  248
• 氢给体数：
  4
• 氢受体数：
  12