38,41-Dichloro-20-[2-(5,5-dimethylhexan-2-yl)-6-propan-2-ylphenyl]-9,34,45-tris[2,6-di(propan-2-yl)phenyl]-46-hydroxy-9,20,34,45-tetrazahexadecacyclo[45.3.1.122,26.02,7.03,28.04,25.05,14.06,11.015,24.018,23.027,32.029,50.030,39.031,36.040,49.043,48]dopentaconta-1(51),2(7),3(28),4,6(11),12,14,16,18(23),22(52),24,26,29,31,36,38,40,42,47,49-icosaene-8,10,19,21,33,35,44-heptone

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 38,41-Dichloro-20-[2-(5,5-dimethylhexan-2-yl)-6-propan-2-ylphenyl]-9,34,45-tris[2,6-di(propan-2-yl)phenyl]-46-hydroxy-9,20,34,45-tetrazahexadecacyclo[45.3.1.122,26.02,7.03,28.04,25.05,14.06,11.015,24.018,23.027,32.029,50.030,39.031,36.040,49.043,48]dopentaconta-1(51),2(7),3(28),4,6(11),12,14,16,18(23),22(52),24,26,29,31,36,38,40,42,47,49-icosaene-8,10,19,21,33,35,44-heptone
• 英文别名: 38,41-dichloro-20-[2-(5,5-dimethylhexan-2-yl)-6-propan-2-ylphenyl]-9,34,45-tris[2,6-di(propan-2-yl)phenyl]-46-hydroxy-9,20,34,45-tetrazahexadecacyclo[45.3.1.122,26.02,7.03,28.04,25.05,14.06,11.015,24.018,23.027,32.029,50.030,39.031,36.040,49.043,48]dopentaconta-1(51),2(7),3(28),4,6(11),12,14,16,18(23),22(52),24,26,29,31,36,38,40,42,47,49-icosaene-8,10,19,21,33,35,44-heptone
• 化学式: C₁₀₁H₈₈Cl₂N₄O₈
• 分子量: 1556.7
• InChiKey: VBPCNBFFNBLDRZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  26.4
• 重原子数：
  115
• 可旋转键数：
  15
• 环数：
  20.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  153
• 氢给体数：
  1
• 氢受体数：
  8