6-(Cyclohexylamino)-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione;6-(diethylamino)-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione;2-[2-(dimethylamino)ethyl]-6-(hexylamino)benzo[de]isoquinoline-1,3-dione;2-[2-(dimethylamino)ethyl]-6-piperidin-1-ylbenzo[de]isoquinoline-1,3-dione

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 异喹啉及其衍生物
• 英文名称: 6-(Cyclohexylamino)-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione;6-(diethylamino)-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione;2-[2-(dimethylamino)ethyl]-6-(hexylamino)benzo[de]isoquinoline-1,3-dione;2-[2-(dimethylamino)ethyl]-6-piperidin-1-ylbenzo[de]isoquinoline-1,3-dione
• 英文别名: 6-(cyclohexylamino)-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione;6-(diethylamino)-2-[2-(dimethylamino)ethyl]benzo[de]isoquinoline-1,3-dione;2-[2-(dimethylamino)ethyl]-6-(hexylamino)benzo[de]isoquinoline-1,3-dione;2-[2-(dimethylamino)ethyl]-6-piperidin-1-ylbenzo[de]isoquinoline-1,3-dione
• 化学式: C85H106N12O8
• 分子量: 1423.8
• InChiKey: KFALSQCIFLWNAZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  13.56
• 重原子数：
  105
• 可旋转键数：
  24
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.44
• 拓扑面积：
  193
• 氢给体数：
  2
• 氢受体数：
  16