3-[4-[4-Methyl-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]-1-bicyclo[2.2.2]octanyl]-5-(2,2,2-trifluoroethyl)-1,2,4-oxadiazole;3-[4-[4-methyl-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]-1-bicyclo[2.2.2]octanyl]-5-(3,3,3-trifluoropropyl)-1,2,4-oxadiazole

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 3-[4-[4-Methyl-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]-1-bicyclo[2.2.2]octanyl]-5-(2,2,2-trifluoroethyl)-1,2,4-oxadiazole;3-[4-[4-methyl-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]-1-bicyclo[2.2.2]octanyl]-5-(3,3,3-trifluoropropyl)-1,2,4-oxadiazole
• 英文别名: 3-[4-[4-methyl-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]-1-bicyclo[2.2.2]octanyl]-5-(2,2,2-trifluoroethyl)-1,2,4-oxadiazole;3-[4-[4-methyl-5-[2-(trifluoromethyl)phenyl]-1,2,4-triazol-3-yl]-1-bicyclo[2.2.2]octanyl]-5-(3,3,3-trifluoropropyl)-1,2,4-oxadiazole
• 化学式: C45H44F12N10O2
• 分子量: 984.9
• InChiKey: YORDXJJUMVAQCY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.45
• 重原子数：
  69
• 可旋转键数：
  9
• 环数：
  11.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  139
• 氢给体数：
  0
• 氢受体数：
  22