18-Chloro-45-(4-ethylphenyl)-11,15,22,40,50-pentamethyl-11,22,40,45,50-pentazaheptadecacyclo[31.18.1.124,28.03,32.04,9.05,30.06,27.07,16.08,13.017,26.020,25.029,38.031,36.034,46.035,44.037,42.048,52]tripentaconta-1(52),2,4(9),5,7(16),8(13),14,17,19,24(53),25,27,29,31(36),32,34(46),35(44),37,42,47-icosaene-10,12,21,39,41,49,51-heptone

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 18-Chloro-45-(4-ethylphenyl)-11,15,22,40,50-pentamethyl-11,22,40,45,50-pentazaheptadecacyclo[31.18.1.124,28.03,32.04,9.05,30.06,27.07,16.08,13.017,26.020,25.029,38.031,36.034,46.035,44.037,42.048,52]tripentaconta-1(52),2,4(9),5,7(16),8(13),14,17,19,24(53),25,27,29,31(36),32,34(46),35(44),37,42,47-icosaene-10,12,21,39,41,49,51-heptone
• 英文别名: 18-chloro-45-(4-ethylphenyl)-11,15,22,40,50-pentamethyl-11,22,40,45,50-pentazaheptadecacyclo[31.18.1.124,28.03,32.04,9.05,30.06,27.07,16.08,13.017,26.020,25.029,38.031,36.034,46.035,44.037,42.048,52]tripentaconta-1(52),2,4(9),5,7(16),8(13),14,17,19,24(53),25,27,29,31(36),32,34(46),35(44),37,42,47-icosaene-10,12,21,39,41,49,51-heptone
• 化学式: C₆₁H₃₂ClN₅O₇
• 分子量: 982.4
• InChiKey: IHTZDDKUQWHDOD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.4
• 重原子数：
  74
• 可旋转键数：
  2
• 环数：
  18.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  137
• 氢给体数：
  0
• 氢受体数：
  7