[5-Fluoro-6-(4-methyl-piperidin-1-yl)-1H-benzoimidazol-2-yl]-carbamic acid methyl ester

• 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: [5-Fluoro-6-(4-methyl-piperidin-1-yl)-1H-benzoimidazol-2-yl]-carbamic acid methyl ester
• 英文别名: methyl N-[6-fluoro-5-(4-methylpiperidin-1-yl)-1H-benzimidazol-2-yl]carbamate
• 化学式: C₁₅H₁₉FN₄O₂
• 分子量: 306.34
• InChiKey: KGKOWOFWODGVSV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  70.2
• 氢给体数：
  2
• 氢受体数：
  5

反应信息

• 作为产物：
  描述：

  5-氯-4-氟-2-硝基苯胺 在 盐酸 、 三乙胺 、 tin(ll) chloride 作用下， 以 乙醇 为溶剂， 反应 8.5h， 生成 [5-Fluoro-6-(4-methyl-piperidin-1-yl)-1H-benzoimidazol-2-yl]-carbamic acid methyl ester
  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.