2-(4-fluorophenyl)-1-(3-methoxyphenyl)-4,5-dimethyl-1H-imidazole | 1354789-57-3

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 2-(4-fluorophenyl)-1-(3-methoxyphenyl)-4,5-dimethyl-1H-imidazole
• 英文别名: 2-(4-fluorophenyl)-1-(3-methoxyphenyl)-4,5-dimethylimidazole
• CAS: 1354789-57-3
• 化学式: C₁₈H₁₇FN₂O
• 分子量: 296.344
• InChiKey: SGXIFNBPXUXCSG-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.2
• 重原子数：
  22
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  27
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  对氟苯甲醛 、 间氨基苯甲醚 、 2,3-丁二酮 在 ammonium acetate 作用下， 生成 2-(4-fluorophenyl)-1-(3-methoxyphenyl)-4,5-dimethyl-1H-imidazole
  参考文献：
  名称：

  Synthesis, spectral studies and solvatochromic analysis of novel imidazole derivatives

  摘要：

  Bioactive imidazole derivatives were synthesized and characterized by spectral techniques. The photophysical properties of imidazole derivatives were studied in several solvents. The observed spectral shift is attributed to a loss of planarity in the excited state provided by the non-co-planarity of the aryl rings attached to C(2) and N(1) atoms of the imidazole ring. The observed solvatochromic shifts were analyzed in detail by Kamlet-Taft and Catalan parameters. The interaction between bioactive imidazole derivative and bovine serum albumin (BSA) was also investigated. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.saa.2011.12.060