Tert-butyl 3-[2-[[6-[[3-[5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]pentanoylamino]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]oxy-5-(trifluoromethyl)phenyl]carbamoyl]pyrimidine-4-carbonyl]amino]-6-[5-[1-[(2-methylpropan-2-yl)oxycarbonylamino]butylideneamino]pentanoylamino]-4-(trifluoromethyl)phenoxy]pyrrolidine-1-carboxylate

• 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: Tert-butyl 3-[2-[[6-[[3-[5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]pentanoylamino]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]oxy-5-(trifluoromethyl)phenyl]carbamoyl]pyrimidine-4-carbonyl]amino]-6-[5-[1-[(2-methylpropan-2-yl)oxycarbonylamino]butylideneamino]pentanoylamino]-4-(trifluoromethyl)phenoxy]pyrrolidine-1-carboxylate
• 英文别名: tert-butyl 3-[2-[[6-[[3-[5-[bis[(2-methylpropan-2-yl)oxycarbonylamino]methylideneamino]pentanoylamino]-2-[1-[(2-methylpropan-2-yl)oxycarbonyl]pyrrolidin-3-yl]oxy-5-(trifluoromethyl)phenyl]carbamoyl]pyrimidine-4-carbonyl]amino]-6-[5-[1-[(2-methylpropan-2-yl)oxycarbonylamino]butylideneamino]pentanoylamino]-4-(trifluoromethyl)phenoxy]pyrrolidine-1-carboxylate
• 化学式: C₆₈H₉₅F₆N₁₃O₁₆
• 分子量: 1464.5
• InChiKey: YAKZGGYUNUAGKH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  10.2
• 重原子数：
  103
• 可旋转键数：
  35
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  359
• 氢给体数：
  7
• 氢受体数：
  26