4-[4-[[4-[4-[[[5-[5-[1-[2-[5-Carbamoyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-5-hydroxy-4-morpholin-4-ylsulfonylphenoxy]propan-2-ylsulfamoyl]-2,4-dihydroxyphenyl]-4-(4-methylphenyl)-1,2,4-triazole-3-carbonyl]amino]methyl]phenyl]-5-[2,4-dihydroxy-5-(2-methylpropylsulfamoyl)phenyl]-1,2,4-triazole-3-carbonyl]amino]phenyl]-5-[2,4-dihydroxy-5-(2-morpholin-4-ylethylsulfamoyl)phenyl]-1,2,4-triazole-3-carboxamide

• 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-[4-[[4-[4-[[[5-[5-[1-[2-[5-Carbamoyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-5-hydroxy-4-morpholin-4-ylsulfonylphenoxy]propan-2-ylsulfamoyl]-2,4-dihydroxyphenyl]-4-(4-methylphenyl)-1,2,4-triazole-3-carbonyl]amino]methyl]phenyl]-5-[2,4-dihydroxy-5-(2-methylpropylsulfamoyl)phenyl]-1,2,4-triazole-3-carbonyl]amino]phenyl]-5-[2,4-dihydroxy-5-(2-morpholin-4-ylethylsulfamoyl)phenyl]-1,2,4-triazole-3-carboxamide
• 英文别名: 4-[4-[[4-[4-[[[5-[5-[1-[2-[5-carbamoyl-4-(4-methylphenyl)-1,2,4-triazol-3-yl]-5-hydroxy-4-morpholin-4-ylsulfonylphenoxy]propan-2-ylsulfamoyl]-2,4-dihydroxyphenyl]-4-(4-methylphenyl)-1,2,4-triazole-3-carbonyl]amino]methyl]phenyl]-5-[2,4-dihydroxy-5-(2-methylpropylsulfamoyl)phenyl]-1,2,4-triazole-3-carbonyl]amino]phenyl]-5-[2,4-dihydroxy-5-(2-morpholin-4-ylethylsulfamoyl)phenyl]-1,2,4-triazole-3-carboxamide
• 化学式: C₈₀H₈₃N₂₁O₂₂S₄
• 分子量: 1818.9
• InChiKey: RMRWDYQQIAMXHN-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.1
• 重原子数：
  127
• 可旋转键数：
  32
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.25
• 拓扑面积：
  649
• 氢给体数：
  14
• 氢受体数：
  35