2,4-dimethyl-6-(7,8,9-triazatricyclo[4.3.0.07,9]nona-1,3,5-trien-8-yl)phenol;(4-hydroxyphenyl) 4-[1-[2-(4-butan-2-yloxyphenyl)hydrazinyl]-1-oxododecan-2-yl]oxybenzenesulfinate;(E)-2-methyl-3-(4-methylphenyl)prop-2-enenitrile;2-methyl-5-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]benzene-1,4-diol;phenyl 2-[[5-[(5,8-dihydroxy-3,4-dimethyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate

• 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: 2,4-dimethyl-6-(7,8,9-triazatricyclo[4.3.0.07,9]nona-1,3,5-trien-8-yl)phenol;(4-hydroxyphenyl) 4-[1-[2-(4-butan-2-yloxyphenyl)hydrazinyl]-1-oxododecan-2-yl]oxybenzenesulfinate;(E)-2-methyl-3-(4-methylphenyl)prop-2-enenitrile;2-methyl-5-[(5-methylsulfanyl-1,3,4-thiadiazol-2-yl)sulfanyl]benzene-1,4-diol;phenyl 2-[[5-[(5,8-dihydroxy-3,4-dimethyl-2-oxo-3,4-dihydro-1H-quinolin-6-yl)sulfanyl]-1,3,4-thiadiazol-2-yl]sulfanyl]acetate
• 化学式: C90H99N11O14S7
• 分子量: 1783.3
• InChiKey: LIPXZWFTNRCCFP-DGKSZRIPSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  21.38
• 重原子数：
  122
• 可旋转键数：
  32
• 环数：
  14.0
• sp3杂化的碳原子比例：
  0.29
• 拓扑面积：
  529
• 氢给体数：
  9
• 氢受体数：
  27