2-(4-chlorophenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazolidin-4-one

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-(4-chlorophenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazolidin-4-one
• 化学式: C₁₅H₁₃ClN₂OS
• 分子量: 304.8
• InChiKey: GSJPJDRUSWNREX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.9
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.2
• 拓扑面积：
  58.5
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  N-(4-chlorobenzylidene)(pyridin-3-yl)methanamine 、 巯基乙酸 以 甲苯 为溶剂， 反应 0.08h， 生成 2-(4-chlorophenyl)-3-(pyridin-3-ylmethyl)-1,3-thiazolidin-4-one
  参考文献：
  名称：

  Thiazolidin-4-ones from 3-(Aminomethyl)pyridine, Arenealdehydes and Mercaptoacetic Acid: Synthesis and Radical Scavenger Activity

  摘要：

  The efficient synthesis of fifteen novel thiazolidin-4-ones from reaction of 3-(aminomethyl) pyridine (3-picolylamine), arenealdenhydes and mercaptoacetic acid was described. The desired compounds were obtained in moderated to good yields by two methodologies: conventional heating and ultrasound irradiation. The thiazolidin-4-ones were fully identified and characterized by nuclear magnetic resonance (NMR), gas chromatography coupled to mass spectrometry (GC-MS) and high resolution mass spectrometry (HRMS) techniques. Four compounds showed radical scavenger activity in the 2,2'-azinobis-3-ethyl-benzothiazoline-6-sulfonic acid (ABTS) assay.

  DOI：

  10.5935/0103-5053.20140291