1-[4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone;1-(4-hydroxy-4-phenylpiperidin-1-yl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone;1-(3-hydroxypiperidin-1-yl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone;5-[1-phenyl-2-(4-phenylpiperidin-1-yl)prop-2-enyl]-1H-pyrazolo[3,4-d]pyrimidine-4-thione

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 哌啶类
• 英文名称: 1-[4-(4-bromophenyl)-4-hydroxypiperidin-1-yl]-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone;1-(4-hydroxy-4-phenylpiperidin-1-yl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone;1-(3-hydroxypiperidin-1-yl)-2-phenyl-2-(4-sulfanylidene-1H-pyrazolo[3,4-d]pyrimidin-5-yl)ethanone;5-[1-phenyl-2-(4-phenylpiperidin-1-yl)prop-2-enyl]-1H-pyrazolo[3,4-d]pyrimidine-4-thione
• 化学式: C91H89BrN20O6S4
• 分子量: 1767.0
• InChiKey: PCDPZJKJNGRNKX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  15.47
• 重原子数：
  122
• 可旋转键数：
  16
• 环数：
  19.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  430
• 氢给体数：
  7
• 氢受体数：
  19