Carboxymethyl-dimethyl-[3-[[2-(4-methylphenyl)acetyl]amino]propyl]azanium;3-[4-hydroxy-1-[3-(4-methylphenyl)propyl]piperidin-1-ium-1-yl]propane-1-sulfonic acid;3-[4-[3-[[2-(4-methylphenyl)acetyl]amino]propyl]morpholin-4-ium-4-yl]propane-1-sulfonic acid;3-[4-[3-(4-methylphenyl)propyl]morpholin-4-ium-4-yl]propane-1-sulfonic acid;2-[4-[3-(2,4,6-trimethylphenyl)propyl]morpholin-4-ium-4-yl]acetic acid

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: Carboxymethyl-dimethyl-[3-[[2-(4-methylphenyl)acetyl]amino]propyl]azanium;3-[4-hydroxy-1-[3-(4-methylphenyl)propyl]piperidin-1-ium-1-yl]propane-1-sulfonic acid;3-[4-[3-[[2-(4-methylphenyl)acetyl]amino]propyl]morpholin-4-ium-4-yl]propane-1-sulfonic acid;3-[4-[3-(4-methylphenyl)propyl]morpholin-4-ium-4-yl]propane-1-sulfonic acid;2-[4-[3-(2,4,6-trimethylphenyl)propyl]morpholin-4-ium-4-yl]acetic acid
• 英文别名: carboxymethyl-dimethyl-[3-[[2-(4-methylphenyl)acetyl]amino]propyl]azanium;3-[4-hydroxy-1-[3-(4-methylphenyl)propyl]piperidin-1-ium-1-yl]propane-1-sulfonic acid;3-[4-[3-[[2-(4-methylphenyl)acetyl]amino]propyl]morpholin-4-ium-4-yl]propane-1-sulfonic acid;3-[4-[3-(4-methylphenyl)propyl]morpholin-4-ium-4-yl]propane-1-sulfonic acid;2-[4-[3-(2,4,6-trimethylphenyl)propyl]morpholin-4-ium-4-yl]acetic acid
• 化学式: C88H142N7O19S3+5
• 分子量: 1698.3
• InChiKey: UWFKDTUNLZMIIO-UHFFFAOYSA-S

计算性质

• 辛醇/水分配系数(LogP)：
  9.08
• 重原子数：
  117
• 可旋转键数：
  40
• 环数：
  9.0
• sp3杂化的碳原子比例：
  0.61
• 拓扑面积：
  369
• 氢给体数：
  8
• 氢受体数：
  19