1-[5-Tert-butyl-3-[4-[2-[2-[4-(2,2-dimethyl-3-oxopiperazine-1-carbonyl)-5-[[5-(6-methoxypyridin-3-yl)-2-methylphenyl]carbamoylamino]thiophen-2-yl]-2,3-dimethylpentan-3-yl]oxyethyl]-2,2-dimethyl-3-oxopiperazine-1-carbonyl]thiophen-2-yl]-3-[3-(6-methoxypyridin-3-yl)-4-methylphenyl]urea

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 1-[5-Tert-butyl-3-[4-[2-[2-[4-(2,2-dimethyl-3-oxopiperazine-1-carbonyl)-5-[[5-(6-methoxypyridin-3-yl)-2-methylphenyl]carbamoylamino]thiophen-2-yl]-2,3-dimethylpentan-3-yl]oxyethyl]-2,2-dimethyl-3-oxopiperazine-1-carbonyl]thiophen-2-yl]-3-[3-(6-methoxypyridin-3-yl)-4-methylphenyl]urea
• 英文别名: 1-[5-tert-butyl-3-[4-[2-[2-[4-(2,2-dimethyl-3-oxopiperazine-1-carbonyl)-5-[[5-(6-methoxypyridin-3-yl)-2-methylphenyl]carbamoylamino]thiophen-2-yl]-2,3-dimethylpentan-3-yl]oxyethyl]-2,2-dimethyl-3-oxopiperazine-1-carbonyl]thiophen-2-yl]-3-[3-(6-methoxypyridin-3-yl)-4-methylphenyl]urea
• 化学式: C₆₃H₇₈N₁₀O₉S₂
• 分子量: 1183.5
• InChiKey: BKNLDPWVXCUQGL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.7
• 重原子数：
  84
• 可旋转键数：
  18
• 环数：
  8.0
• sp3杂化的碳原子比例：
  0.43
• 拓扑面积：
  282
• 氢给体数：
  5
• 氢受体数：
  13