Dimethyl 2-[3-[[3-[2-amino-4-methyl-6-(pentylamino)pyrimidin-5-yl]propyl-[2-(4-hydroxypiperidin-1-yl)acetyl]amino]methyl]phenyl]-3-[3-[[3-[2-amino-4-methyl-6-(pentylamino)pyrimidin-5-yl]propyl-[2-(4-methylpiperazin-1-yl)acetyl]amino]methyl]phenyl]butanedioate

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 二苯乙烯类
• 英文名称: Dimethyl 2-[3-[[3-[2-amino-4-methyl-6-(pentylamino)pyrimidin-5-yl]propyl-[2-(4-hydroxypiperidin-1-yl)acetyl]amino]methyl]phenyl]-3-[3-[[3-[2-amino-4-methyl-6-(pentylamino)pyrimidin-5-yl]propyl-[2-(4-methylpiperazin-1-yl)acetyl]amino]methyl]phenyl]butanedioate
• 英文别名: dimethyl 2-[3-[[3-[2-amino-4-methyl-6-(pentylamino)pyrimidin-5-yl]propyl-[2-(4-hydroxypiperidin-1-yl)acetyl]amino]methyl]phenyl]-3-[3-[[3-[2-amino-4-methyl-6-(pentylamino)pyrimidin-5-yl]propyl-[2-(4-methylpiperazin-1-yl)acetyl]amino]methyl]phenyl]butanedioate
• 化学式: C₆₀H₉₁N₁₃O₇
• 分子量: 1106.4
• InChiKey: RFFAUHHFJRJDLL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7.2
• 重原子数：
  80
• 可旋转键数：
  33
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  251
• 氢给体数：
  5
• 氢受体数：
  18