4-[2-[2-(1-methyl-2-{4-(2,4-dioxothiazolidin-5-ylmethyl)phenoxymethyl}-1H-benzimidazol-6-ylthio)acetylamino]ethylthiomethyl]-2-propyl-1-[2'-(1-triphenylmethyl-1H-tetrazol-5-yl)biphenyl-4-ylmethyl]-1H-imidazole-5-carboxylic acid ethyl ester | 1350440-75-3

• 分子结构分类: 有机化合物 - 苯类化合物 - 三苯基化合物
• 英文名称: 4-[2-[2-(1-methyl-2-{4-(2,4-dioxothiazolidin-5-ylmethyl)phenoxymethyl}-1H-benzimidazol-6-ylthio)acetylamino]ethylthiomethyl]-2-propyl-1-[2'-(1-triphenylmethyl-1H-tetrazol-5-yl)biphenyl-4-ylmethyl]-1H-imidazole-5-carboxylic acid ethyl ester
• 英文别名: Ethyl 5-[2-[[2-[2-[[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]methyl]-3-methylbenzimidazol-5-yl]sulfanylacetyl]amino]ethylsulfanylmethyl]-2-propyl-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate；ethyl 5-[2-[[2-[2-[[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]methyl]-3-methylbenzimidazol-5-yl]sulfanylacetyl]amino]ethylsulfanylmethyl]-2-propyl-3-[[4-[2-(1-trityltetrazol-5-yl)phenyl]phenyl]methyl]imidazole-4-carboxylate
• CAS: 1350440-75-3
• 化学式: C₆₆H₆₂N₁₀O₆S₃
• 分子量: 1187.48
• InChiKey: CJLRVMYKCCNZFI-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.2
• 重原子数：
  85
• 可旋转键数：
  26
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  266
• 氢给体数：
  2
• 氢受体数：
  14