3,19,29,45-Tetramethyl-24,50-diphenyl-3,19,24,29,45,50-hexazaoctadecacyclo[36.14.1.112,27.05,53.07,37.08,17.09,35.010,15.011,33.013,25.014,23.016,21.034,43.036,41.039,51.040,49.042,47.031,54]tetrapentaconta-1(52),5(53),6,8,10(15),11,13(25),14(23),16,21,26,31(54),32,34(43),35,37,39(51),40(49),41,47-icosaene-2,4,18,20,28,30,46-heptone

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 3,19,29,45-Tetramethyl-24,50-diphenyl-3,19,24,29,45,50-hexazaoctadecacyclo[36.14.1.112,27.05,53.07,37.08,17.09,35.010,15.011,33.013,25.014,23.016,21.034,43.036,41.039,51.040,49.042,47.031,54]tetrapentaconta-1(52),5(53),6,8,10(15),11,13(25),14(23),16,21,26,31(54),32,34(43),35,37,39(51),40(49),41,47-icosaene-2,4,18,20,28,30,46-heptone
• 英文别名: 3,19,29,45-tetramethyl-24,50-diphenyl-3,19,24,29,45,50-hexazaoctadecacyclo[36.14.1.112,27.05,53.07,37.08,17.09,35.010,15.011,33.013,25.014,23.016,21.034,43.036,41.039,51.040,49.042,47.031,54]tetrapentaconta-1(52),5(53),6,8,10(15),11,13(25),14(23),16,21,26,31(54),32,34(43),35,37,39(51),40(49),41,47-icosaene-2,4,18,20,28,30,46-heptone
• 化学式: C₆₄H₃₀N₆O₇
• 分子量: 995.0
• InChiKey: VACUXDPSWQFMTL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.8
• 重原子数：
  77
• 可旋转键数：
  2
• 环数：
  20.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  142
• 氢给体数：
  0
• 氢受体数：
  7