1-(2-Oxo-propyl)-3-phenyl-3H-imidazol-1-ium; chloride | 121704-69-6

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 1-(2-Oxo-propyl)-3-phenyl-3H-imidazol-1-ium; chloride
• 英文别名: 1-(3-Phenylimidazol-1-ium-1-yl)propan-2-one;chloride
• CAS: 121704-69-6
• 化学式: C₁₂H₁₃N₂O*Cl
• 分子量: 236.701
• InChiKey: UHFMMRUETGIZJF-UHFFFAOYSA-M

计算性质

• 辛醇/水分配系数(LogP)：
  -1.64
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.17
• 拓扑面积：
  25.9
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为产物：
  描述：

  1-苯基咪唑 、 一氯丙酮 以 乙腈 为溶剂， 生成 1-(2-Oxo-propyl)-3-phenyl-3H-imidazol-1-ium; chloride
  参考文献：
  名称：

  Oral hypoglycemic agents. Discovery and structure-activity relationships of phenacylimidazolium halides

  摘要：

  Blood glucose levels in viable, yellow, obese, diabetic mice are reduced following oral administration of phenacylimidazolium halides. Compounds 2 and 3 produced reductions of ca. 40% 2 h after doses of 100 mg/kg po. Since these mice do not respond to sulfonylureas, the glucose-lowering activity of phenacylimidazolium salts in this model suggests a mechanism other than that of stimulating insulin secretion. Only phenacylimidazolium halides with electron-donating groups were active; other azolium salts or variations in the phenacyl portion (alterations in the keto function; chain lengthening or extensive branching) produced inactive compounds.

  DOI：

  10.1021/jm00130a013