1-phenyl-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-2-propenone

• 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-phenyl-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-2-propenone
• 英文别名: 1-Phenyl-3-(1-phenyltriazol-4-yl)prop-2-en-1-one
• 化学式: C₁₇H₁₃N₃O
• 分子量: 275.31
• InChiKey: QMLDAMFADOICFO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.2
• 重原子数：
  21
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  47.8
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  1-苯基-4-甲醇基-1H-1,2,3-三唑 在 2-碘酰苯甲酸 、 potassium hydroxide 作用下， 以 二甲基亚砜 为溶剂， 反应 3.02h， 生成 1-phenyl-3-(1-phenyl-1H-1,2,3-triazol-4-yl)-2-propenone
  参考文献：
  名称：

  Green synthesis and antibacterial evaluation of some new 1-aryl-3-(1-aryl-1H-[1,2,3]triazol-4-yl)-propenones

  摘要：

  A new series of 1-aryl-3-(1-aryl-1H-[1,2,3]triazol-4-yl)propenones (6a-6j) was synthesized by condensation of substituted acetophenones (5a-5c) with substituted 1-aryl-1H-[1,2,3]triazole-4-carbaldehydes (4a-4d) in the presence of potassium hydroxide under conditions of grinding and microwave irradiation. All the newly synthesized compounds were characterized by the IR, NMR, and mass spectroscopic analyses and their antibacterial activity against gram-positive and gram-negative bacterial strains was evaluated. Among the compounds synthesized, better activity was exhibited by 6a, 6c, 6f, 6g, and 6i.

  DOI：

  10.1134/s1070363216060293