(E)-2-(2-hydroxy-6-(difluoromethoxy)-2-phenylbenzo[d]thiazolo[3,2-a]imidazol-3(2H)-ylidene)-1-phenylethanone | 1574570-15-2

• 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: (E)-2-(2-hydroxy-6-(difluoromethoxy)-2-phenylbenzo[d]thiazolo[3,2-a]imidazol-3(2H)-ylidene)-1-phenylethanone
• CAS: 1574570-15-2
• 化学式: C₂₄H₁₆F₂N₂O₃S
• 分子量: 450.465
• InChiKey: XWWMHCHNVRIUGM-KGENOOAVSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.31
• 重原子数：
  32.0
• 可旋转键数：
  5.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  64.35
• 氢给体数：
  1.0
• 氢受体数：
  6.0

反应信息

• 作为产物：
  描述：

  5-二氟甲氧基-2-巯基-1H-苯并咪唑 、 二苯甲酰基乙炔 以 乙腈 为溶剂， 反应 1.58h， 以70%的产率得到(E)-2-(2-hydroxy-6-(difluoromethoxy)-2-phenylbenzo[d]thiazolo[3,2-a]imidazol-3(2H)-ylidene)-1-phenylethanone
  参考文献：
  名称：

  One pot synthesis of imidazo[2,1-b]thiazoles and benzo[d]thiazolo[3,2-a]imidazoles

  摘要：

  A series of imidazo[2,1-b]thiazole and benzo[d]thiazolo[3,2-a]imidazole analogues were synthesized by stirring an equimolar mixture of dibenzoylacetylene with imidazole/thiazole derivatives in toluene or acetonitrile at room temperature. The products were generated in good yields and characterized by standard analytical techniques such as IR, H-1 NMR, C-13 NMR and mass spectrometry. The structure of products 19, 20, 22, 24 and 25 were also unambiguously confirmed by single crystal X-ray analysis. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.01.085