2-hydroxy-3-[[1-[2-hydroxy-3-[5-(2-hydroxyacetyl)-3-[3-[2-(3-hydroxypiperidin-1-yl)ethylsulfanyl]-4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]propyl]piperidin-4-yl]sulfamoyl]-N-[1-[2-hydroxy-3-[3-[3-[2-(4-hydroxypiperidin-1-yl)ethylsulfanyl]-4-(trifluoromethyl)phenyl]-5-methylsulfonyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]propyl]piperidin-4-yl]propanamide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-hydroxy-3-[[1-[2-hydroxy-3-[5-(2-hydroxyacetyl)-3-[3-[2-(3-hydroxypiperidin-1-yl)ethylsulfanyl]-4-(trifluoromethyl)phenyl]-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]propyl]piperidin-4-yl]sulfamoyl]-N-[1-[2-hydroxy-3-[3-[3-[2-(4-hydroxypiperidin-1-yl)ethylsulfanyl]-4-(trifluoromethyl)phenyl]-5-methylsulfonyl-6,7-dihydro-4H-pyrazolo[4,3-c]pyridin-1-yl]propyl]piperidin-4-yl]propanamide
• 化学式: C₆₂H₈₈F₆N₁₂O₁₂S₄
• 分子量: 1435.7
• InChiKey: HAYZJTVZGTUSRS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.2
• 重原子数：
  96
• 可旋转键数：
  26
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.68
• 拓扑面积：
  370
• 氢给体数：
  8
• 氢受体数：
  28