1-(2-methyl-5-nitro-imidazol-1-yl)-2-phenoxycarbonyloxy-ethane | 31478-46-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 1-(2-methyl-5-nitro-imidazol-1-yl)-2-phenoxycarbonyloxy-ethane
• 英文别名: 2-(2-Methyl-5-nitroimidazol-1-yl)ethyl phenyl carbonate
• CAS: 31478-46-3
• 化学式: C₁₃H₁₃N₃O₅
• 分子量: 291.263
• InChiKey: VJZTVYTXXSBNCP-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  21
• 可旋转键数：
  6
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.23
• 拓扑面积：
  99.2
• 氢给体数：
  0
• 氢受体数：
  6

文献信息

• Water soluble derivatives of 1-(2-hydroxyethyl)-2-methyl-5-nitro-imidazole having therapeutical activity, process for its preparation and related pharmaceutical compositions
  申请人：Pietro Isnardi & C. Spa

  公开号：EP0140395A1

  公开（公告）日：1985-05-08

  The N-(5-carboxy-5-aminopentan)-carbonic ester of 1-(2-hydroxyethyl)-2-methyl-5-nitro-imidazole is perfectly soluble in water and shows relevant trichomonacide activity. The process for the preparation of the compound of the invention comprises reacting 1-(2-hydroxyethyl)-2-methyl-5-nitro imidazole with an alkyl- or phenyl-chlorocarbonate and hydrolizing the resulting carbonic ester, after isolation, in a water-alcohol medium with lysine hydrochloride. The invention relates furthermore to the pharmaceutical compositions, containing the derivative according to the invention, in form suitable for the several administration routes, in combination with the usual excipients and additives.

  1-(2-羟乙基)-2-甲基-5-硝基咪唑的 N-(5-羧基-5-氨基戊烷)-碳酸酯完全溶于水，并显示出相关的杀滴虫活性。 制备本发明化合物的工艺包括使 1-(2-羟乙基)-2-甲基-5-硝基咪唑与烷基或苯基氯碳酸酯反应，并将分离后得到的碳酸酯在水-醇介质中与盐酸赖氨酸水解。 本发明还涉及含有本发明衍生物的药物组合物，其形式适用于多种给药途径，并与常用赋形剂和添加剂结合使用。