| 1344111-89-2

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 喹啉及其衍生物
• CAS: 1344111-89-2
• 化学式: C₂₃H₂₃N₅O₃
• 分子量: 417.467
• InChiKey: ZQFNOJXUCKNRFK-UHFFFAOYSA-N

物化性质

• 密度：
  1.42±0.1 g/cm3(Temp: 20 °C; Press: 760 Torr)(predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  3.05
• 重原子数：
  31.0
• 可旋转键数：
  2.0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.35
• 拓扑面积：
  98.48
• 氢给体数：
  1.0
• 氢受体数：
  8.0

反应信息

• 作为产物：
  描述：

  5,5-二甲基-1,3-环己二酮 、 乙酰乙酸甲酯 、 四唑并[1,5-a]喹啉-4-甲醛 在 ammonium acetate 作用下， 以 乙醇 为溶剂， 反应 0.07h， 生成
  参考文献：
  名称：

  Microwave assisted synthesis of novel Hantzsch 1,4-dihydropyridines, acridine-1,8-diones and polyhydroquinolines bearing the tetrazolo[1,5-a]quinoline moiety and their antimicrobial activity assess

  摘要：

  Microwave assisted efficient Hantzsch reaction via four-component coupling reactions of tetrazolo[1,5-a]quinoline-4-carbaldehyde, dimedone/cyclohexane-1,3-dione, ethyl/methyl acetoacetate and ammonium acetate was described as the preparation of tetrazolo[1,5-a]quinoline based 1,4-dihydropyridines, acridine-1,8-diones and polyhydroquinolines. The process presented here is simple, rapid, environmentally welcoming and high yielding. All the derivatives were subjected to an in vitro antimicrobial screening against a representative panel of bacteria and fungi and results worth further investigations. (C) 2011 Divyesh C. Mungra. Published by Elsevier B.V. on behalf of Chinese Chemical Society. All rights reserved.

  DOI：

  10.1016/j.cclet.2011.07.009