2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[2-[3-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methylphenyl]-6'-methyl-4-oxospiro[5H-1,3,5-benzothiadiazepine-2,7'-pyrazolo[1,5-b][1,2,4]triazole]-2'-yl]propyl]propanamide;[2-(methyl-methylidene-oxo-lambda6-sulfanyl)phenyl] N-[2-[1-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]propanoylamino]propan-2-yl]-7-chloro-6-methylpyrazolo[1,5-b][1,2,4]triazol-7-yl]-N-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methylphenyl]carbamimidate

• 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: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[2-[3-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methylphenyl]-6'-methyl-4-oxospiro[5H-1,3,5-benzothiadiazepine-2,7'-pyrazolo[1,5-b][1,2,4]triazole]-2'-yl]propyl]propanamide;[2-(methyl-methylidene-oxo-lambda6-sulfanyl)phenyl] N-[2-[1-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]propanoylamino]propan-2-yl]-7-chloro-6-methylpyrazolo[1,5-b][1,2,4]triazol-7-yl]-N-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methylphenyl]carbamimidate
• 英文别名: 2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[2-[3-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methylphenyl]-6'-methyl-4-oxospiro[5H-1,3,5-benzothiadiazepine-2,7'-pyrazolo[1,5-b][1,2,4]triazole]-2'-yl]propyl]propanamide;[2-(methyl-methylidene-oxo-λ6-sulfanyl)phenyl] N-[2-[1-[2-[2,4-bis(2-methylbutan-2-yl)phenoxy]propanoylamino]propan-2-yl]-7-chloro-6-methylpyrazolo[1,5-b][1,2,4]triazol-7-yl]-N-[4-[ethyl-[2-(methanesulfonamido)ethyl]amino]-2-methylphenyl]carbamimidate
• 化学式: C94H131ClN18O11S4
• 分子量: 1852.9
• InChiKey: PZSZDOHIEAPNIF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  16.14
• 重原子数：
  128
• 可旋转键数：
  39
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.5
• 拓扑面积：
  398
• 氢给体数：
  6
• 氢受体数：
  23