Ethyl 2-(5-fluoro-6-morpholin-4-yl-1-propylbenzimidazol-2-yl)acetate | 413597-48-5

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并咪唑类
• 英文名称: Ethyl 2-(5-fluoro-6-morpholin-4-yl-1-propylbenzimidazol-2-yl)acetate
• CAS: 413597-48-5
• 化学式: C₁₈H₂₄FN₃O₃
• 分子量: 349.405
• InChiKey: TZFASSRXRPIGAA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.3
• 重原子数：
  25
• 可旋转键数：
  7
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.56
• 拓扑面积：
  56.6
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  Ethyl 2-(5-fluoro-6-morpholin-4-yl-1-propylbenzimidazol-2-yl)acetate 在 ammonium hydroxide 、 氨 、 氯化铵 作用下， 以 乙醇 为溶剂， 反应 48.0h， 以62%的产率得到2-(5-Fluoro-6-morpholin-4-yl-1-propylbenzimidazol-2-yl)acetamide
  参考文献：
  名称：

  Synthesis and antimicrobial activities of 5-fluoro-1,2,6-trisubstituted benzimidazole carboxamide and acetamide derivatives

  摘要：

  Some 5-fluoro-6-substitute-1H-benzimidazole-2-carbamates (12a-e), 5-fluoro-6-substituted 1H-benzimidazole-2-acetate (13a-e) and 2-acetamide (14a-f) derivatives, 2-acetamido-5-fluoro-6-(morpholin-4-yl)-1-propyl-1H-benzimidazole (15), and 1-cyclopropyl-2-ethyl-5-fluoro-6-(4-methylpiperazin-1-yl)-1H-benzimidazole (16) were synthesized, and their antimicrobial and antifungal activities evaluated. Compound 12c exhibited the best activity against Candida albicans.

  DOI：

  10.1002/1521-4184(200112)334:11<361::aid-ardp361>3.0.co;2-9
• 作为产物：
  描述：

  4-氯-2,5-二氟硝基苯 在 10% palladium on active carbon 氢气 、 三乙胺 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 7.0h， 生成 Ethyl 2-(5-fluoro-6-morpholin-4-yl-1-propylbenzimidazol-2-yl)acetate
  参考文献：
  名称：

  Synthesis and antimicrobial activities of 5-fluoro-1,2,6-trisubstituted benzimidazole carboxamide and acetamide derivatives

  摘要：

  Some 5-fluoro-6-substitute-1H-benzimidazole-2-carbamates (12a-e), 5-fluoro-6-substituted 1H-benzimidazole-2-acetate (13a-e) and 2-acetamide (14a-f) derivatives, 2-acetamido-5-fluoro-6-(morpholin-4-yl)-1-propyl-1H-benzimidazole (15), and 1-cyclopropyl-2-ethyl-5-fluoro-6-(4-methylpiperazin-1-yl)-1H-benzimidazole (16) were synthesized, and their antimicrobial and antifungal activities evaluated. Compound 12c exhibited the best activity against Candida albicans.

  DOI：

  10.1002/1521-4184(200112)334:11<361::aid-ardp361>3.0.co;2-9

文献信息

• Synthesis and antimicrobial activities of 5-fluoro-1,2,6-trisubstituted benzimidazole carboxamide and acetamide derivatives
  作者：Canan Kus、Hakan Göker、Nurten Altanlar

  DOI：10.1002/1521-4184(200112)334:11<361::aid-ardp361>3.0.co;2-9

  日期：2001.12

  Some 5-fluoro-6-substitute-1H-benzimidazole-2-carbamates (12a-e), 5-fluoro-6-substituted 1H-benzimidazole-2-acetate (13a-e) and 2-acetamide (14a-f) derivatives, 2-acetamido-5-fluoro-6-(morpholin-4-yl)-1-propyl-1H-benzimidazole (15), and 1-cyclopropyl-2-ethyl-5-fluoro-6-(4-methylpiperazin-1-yl)-1H-benzimidazole (16) were synthesized, and their antimicrobial and antifungal activities evaluated. Compound 12c exhibited the best activity against Candida albicans.