5-Decoxy-2-(4-hexoxyphenyl)pyrimidine;5-dodecoxy-2-(4-methylphenyl)pyrimidine;5-methyl-2-(4-methylphenyl)pyrimidine;methyl 2-(4-pentylphenyl)pyrimidine-5-carboxylate;nonyl 2-(4-nonylphenyl)pyrimidine-5-carboxylate;octyl 2-(4-tridecanoyloxyphenyl)pyrimidine-5-carboxylate

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚酯
• 英文名称: 5-Decoxy-2-(4-hexoxyphenyl)pyrimidine;5-dodecoxy-2-(4-methylphenyl)pyrimidine;5-methyl-2-(4-methylphenyl)pyrimidine;methyl 2-(4-pentylphenyl)pyrimidine-5-carboxylate;nonyl 2-(4-nonylphenyl)pyrimidine-5-carboxylate;octyl 2-(4-tridecanoyloxyphenyl)pyrimidine-5-carboxylate
• 英文别名: 5-decoxy-2-(4-hexoxyphenyl)pyrimidine;5-dodecoxy-2-(4-methylphenyl)pyrimidine;5-methyl-2-(4-methylphenyl)pyrimidine;methyl 2-(4-pentylphenyl)pyrimidine-5-carboxylate;nonyl 2-(4-nonylphenyl)pyrimidine-5-carboxylate;octyl 2-(4-tridecanoyloxyphenyl)pyrimidine-5-carboxylate
• 化学式: C139H198N12O11
• 分子量: 2213.1
• InChiKey: DQPVPDFQMWMIFW-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  38.02
• 重原子数：
  162
• 可旋转键数：
  80
• 环数：
  12.0
• sp3杂化的碳原子比例：
  0.54
• 拓扑面积：
  288
• 氢给体数：
  0
• 氢受体数：
  23