1-(1H-benzimidazol-2-yl)-2-phenylethanol | 15452-38-7

• 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: 1-(1H-benzimidazol-2-yl)-2-phenylethanol
• 英文别名: 2-(α-Hydroxy-phenethyl)-benzimidazol；1-(1H-benzoimidazol-2-yl)-2-phenyl-ethanol；1-(1H-Benzo[d]imidazol-2-yl)-2-phenylethanol
• CAS: 15452-38-7
• 化学式: C₁₅H₁₄N₂O
• 分子量: 238.289
• InChiKey: GUBATVXKUROIST-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  18
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.13
• 拓扑面积：
  48.9
• 氢给体数：
  2
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1-(1-Diethoxymethyl-1H-benzoimidazol-2-yl)-2-phenyl-ethanol 在 盐酸 作用下， 反应 0.5h， 生成 1-(1H-benzimidazol-2-yl)-2-phenylethanol
  参考文献：
  名称：

  Ooi, Hong Chin; Suschitzky, Hans, Journal of the Chemical Society. Perkin transactions I, 1982, # 12, p. 2871 - 2876

  摘要：

  DOI：

文献信息

• Benzimidazole, Benzoxazole and Benzothiazole Derivatives as 5HT2B Receptor Ligands. Synthesis and Preliminary Pharmacological Evaluation
  作者：G. Giorgioni、B. Accorroni、A. Di Stefano、G. Marucci、A. Siniscalchi、F. Claudi

  DOI：10.1007/s00044-005-0125-z

  日期：2005.2

  2-Phenethylbenzimidazole, 2-phenethylbenzoxazole and 2phenethylbenzothiazole derivatives were synthesized to explore the structural features of the serotonin 5-HT2B receptor antagonists. Those molecules were designed to recognize the 5-HT2B receptor and to discriminate it from the 5-HT2A and 5-HT2C subtypes. All compounds were characterized by binding affinity determination for 5-HT2A and 5-HT2C subtypes and antagonistic activity for 5-HT2B receptor in rat stomach fundus. None of the new compounds showed affinity for 5-HT2A and 5-HT2C subtypes, but some of them displayed antagonistic activity in rat stomach fundus at micromolar concentrations.
• Ooi, Hong Chin; Suschitzky, Hans, Journal of the Chemical Society. Perkin transactions I, 1982, # 12, p. 2871 - 2876
  作者：Ooi, Hong Chin、Suschitzky, Hans

  DOI：——

  日期：——