S-(1-phenyltetrazol-5-yl) N-[[2-[4-hydroxy-3-[(2-methylphenyl)carbamoyl]naphthalen-1-yl]oxy-5-nitrophenyl]methyl]-N-propan-2-ylcarbamothioate;propyl 2-[5-[[4-(3-carbamoyl-4-hydroxynaphthalen-1-yl)oxy-3-methylphenyl]methylsulfanyl]tetrazol-1-yl]acetate

• 分子结构分类: 有机化合物 - 苯类化合物 - 萘
• 英文名称: S-(1-phenyltetrazol-5-yl) N-[[2-[4-hydroxy-3-[(2-methylphenyl)carbamoyl]naphthalen-1-yl]oxy-5-nitrophenyl]methyl]-N-propan-2-ylcarbamothioate;propyl 2-[5-[[4-(3-carbamoyl-4-hydroxynaphthalen-1-yl)oxy-3-methylphenyl]methylsulfanyl]tetrazol-1-yl]acetate
• 化学式: C61H56N12O11S2
• 分子量: 1197.3
• InChiKey: WGIZBFHTRBIQFU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  11.88
• 重原子数：
  86
• 可旋转键数：
  21
• 环数：
  10.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  361
• 氢给体数：
  4
• 氢受体数：
  19