4'-[6-{4-(3-(N-t-butoxycarbonyl-N-methylamino)-4-[4-(2,4-dioxothiazolidin-5-ylmethyl)phenoxymethylcarbonylamino]phenoxy)phenylthiomethyl}-4-methyl-2-propyl-1H-benzimidazol-1-ylmethyl]biphenyl-2-carboxylic acid t-butyl ester | 1350440-15-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 4'-[6-{4-(3-(N-t-butoxycarbonyl-N-methylamino)-4-[4-(2,4-dioxothiazolidin-5-ylmethyl)phenoxymethylcarbonylamino]phenoxy)phenylthiomethyl}-4-methyl-2-propyl-1H-benzimidazol-1-ylmethyl]biphenyl-2-carboxylic acid t-butyl ester
• 英文别名: Tert-butyl 2-[4-[[6-[[4-[4-[[2-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]acetyl]amino]-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenoxy]phenyl]sulfanylmethyl]-4-methyl-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoate；tert-butyl 2-[4-[[6-[[4-[4-[[2-[4-[(2,4-dioxo-1,3-thiazolidin-5-yl)methyl]phenoxy]acetyl]amino]-3-[methyl-[(2-methylpropan-2-yl)oxycarbonyl]amino]phenoxy]phenyl]sulfanylmethyl]-4-methyl-2-propylbenzimidazol-1-yl]methyl]phenyl]benzoate
• CAS: 1350440-15-1
• 化学式: C₆₀H₆₃N₅O₉S₂
• 分子量: 1062.32
• InChiKey: RNHTWHXYJSTFTA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.3
• 重原子数：
  76
• 可旋转键数：
  22
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  218
• 氢给体数：
  2
• 氢受体数：
  12