N-[3,3-diethyl-4-hydroxy-2-oxo-7-[(4-oxocyclohexa-2,5-dien-1-ylidene)amino]-1H-indol-5-yl]-3,5-bis[(4-methylphenoxy)sulfinylamino]benzamide;4,4-dimethyl-N-(2-methylphenyl)-8-(5-morpholin-4-ylpyridin-2-yl)imino-2,5-dioxo-1,3-dihydroquinoline-6-carboxamide;N-(2,4-dimethylphenyl)-4,4-dimethyl-2,5-dioxo-8-(5-pyrrolidin-1-ylpyridin-2-yl)imino-1,3-dihydroquinoline-6-carboxamide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• 英文名称: N-[3,3-diethyl-4-hydroxy-2-oxo-7-[(4-oxocyclohexa-2,5-dien-1-ylidene)amino]-1H-indol-5-yl]-3,5-bis[(4-methylphenoxy)sulfinylamino]benzamide;4,4-dimethyl-N-(2-methylphenyl)-8-(5-morpholin-4-ylpyridin-2-yl)imino-2,5-dioxo-1,3-dihydroquinoline-6-carboxamide;N-(2,4-dimethylphenyl)-4,4-dimethyl-2,5-dioxo-8-(5-pyrrolidin-1-ylpyridin-2-yl)imino-1,3-dihydroquinoline-6-carboxamide
• 化学式: C96H97N15O15S2
• 分子量: 1765.0
• InChiKey: JBSAVRLBLUYHHK-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  14.74
• 重原子数：
  128
• 可旋转键数：
  21
• 环数：
  16.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  440
• 氢给体数：
  9
• 氢受体数：
  26