2,2,2-trifluoro-N-(1-phenyl-2-(trifluoromethyl)-1H-benzo[d]imidazol-5-yl)acetamide | 627469-49-2

• 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: 2,2,2-trifluoro-N-(1-phenyl-2-(trifluoromethyl)-1H-benzo[d]imidazol-5-yl)acetamide
• 英文别名: 2,2,2-trifluoro-N-[1-phenyl-2-(trifluoromethyl)benzimidazol-5-yl]acetamide
• CAS: 627469-49-2
• 化学式: C₁₆H₉F₆N₃O
• 分子量: 373.257
• InChiKey: FBDJWOQBGBHKFY-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.3
• 重原子数：
  26
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  46.9
• 氢给体数：
  1
• 氢受体数：
  8

反应信息

• 作为产物：
  描述：

  2,4-二氨基二苯胺 、 三氟乙酸 反应 16.0h， 以66%的产率得到2,2,2-trifluoro-N-(1-phenyl-2-(trifluoromethyl)-1H-benzo[d]imidazol-5-yl)acetamide
  参考文献：
  名称：

  Efficient syntheses of 2-fluoroalkylbenzimidazoles and -benzothiazoles

  摘要：

  We report an efficient one-step route to 2-fluoroalkylbenzimidazoles and -benzothiazoles via the condensation of fluorinated carboxylic acids and aromatic diamines or aminothiophenols. Additionally, we describe the syntheses of fluoroalkyl-azabenzimidazoles, -purines, and -imidazolopyrazines. This method is high-yielding with broad scope and is operationally simple with potential application to parallel synthesis. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.09.069

文献信息

• Efficient syntheses of 2-fluoroalkylbenzimidazoles and -benzothiazoles
  作者：Olivier René、Alexandra Souverneva、Steven R. Magnuson、Benjamin P. Fauber

  DOI：10.1016/j.tetlet.2012.09.069

  日期：2013.1

  We report an efficient one-step route to 2-fluoroalkylbenzimidazoles and -benzothiazoles via the condensation of fluorinated carboxylic acids and aromatic diamines or aminothiophenols. Additionally, we describe the syntheses of fluoroalkyl-azabenzimidazoles, -purines, and -imidazolopyrazines. This method is high-yielding with broad scope and is operationally simple with potential application to parallel synthesis. (C) 2012 Elsevier Ltd. All rights reserved.