N-[4-[(7Z)-6-tert-butyl-7-[[2-fluoro-4-[[3-[(2-hydroxy-4,5-dimethylphenyl)methyl]-4-morpholin-4-ylphenyl]methyl]phenyl]hydrazinylidene]pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]methanesulfonamide;N-[5-chloro-3-[2-[4-cyano-2-[2,5-dichloro-4-[[3-[(2-hydroxy-4,5-dimethylphenyl)sulfamoyl]-4-morpholin-4-ylphenyl]sulfamoyl]phenyl]pyrazol-3-yl]hydrazinyl]-6-oxocyclohexa-2,4-dien-1-ylidene]propanamide

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二芳基庚烷
• 英文名称: N-[4-[(7Z)-6-tert-butyl-7-[[2-fluoro-4-[[3-[(2-hydroxy-4,5-dimethylphenyl)methyl]-4-morpholin-4-ylphenyl]methyl]phenyl]hydrazinylidene]pyrazolo[1,5-b][1,2,4]triazol-2-yl]phenyl]methanesulfonamide;N-[5-chloro-3-[2-[4-cyano-2-[2,5-dichloro-4-[[3-[(2-hydroxy-4,5-dimethylphenyl)sulfamoyl]-4-morpholin-4-ylphenyl]sulfamoyl]phenyl]pyrazol-3-yl]hydrazinyl]-6-oxocyclohexa-2,4-dien-1-ylidene]propanamide
• 化学式: C78H79Cl3FN17O12S3
• 分子量: 1668.1
• InChiKey: XFIWIMRVYBUODI-RBNDSFJXSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  12.57
• 重原子数：
  114
• 可旋转键数：
  23
• 环数：
  13.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  409
• 氢给体数：
  8
• 氢受体数：
  27