1-(2-cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid amide | 1430061-22-5

• 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
• 英文名称: 1-(2-cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid amide
• 英文别名: 1-(2-Cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamide；1-(2-cyanoethyl)-4-hydroxy-2-oxoquinoline-3-carboxamide
• CAS: 1430061-22-5
• 化学式: C₁₃H₁₁N₃O₃
• 分子量: 257.249
• InChiKey: SALLDVNLUPCOGV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.8
• 重原子数：
  19
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.15
• 拓扑面积：
  107
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  1-(2-cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid amide 在 potassium hydroxide 作用下， 以 水 为溶剂， 反应 4.0h， 以20%的产率得到3-(3-carbamoyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-1-yl)propanoic acid
  参考文献：
  名称：

  4-Hydroxy-2-quinolones. 221.* Synthesis, structure, and biological activity of 3-(3-(alkylcarbamoyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-1-yl)propanoic acids

  摘要：

  A simple method is proposed and used for preparing a series of 3-(3-alkylcarbamoyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-1-yl)propanoic acids. A comparative analysis was carried out on the analgesic and diuretic properties of these compounds and their synthetic precursors, namely, the corresponding 1-(2-cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamides.

  DOI：

  10.1007/s10593-013-1213-5
• 作为产物：
  描述：

  1-(2-cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid ethyl ester 在 氨 作用下， 以82%的产率得到1-(2-cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxylic acid amide
  参考文献：
  名称：

  4-Hydroxy-2-quinolones. 221.* Synthesis, structure, and biological activity of 3-(3-(alkylcarbamoyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-1-yl)propanoic acids

  摘要：

  A simple method is proposed and used for preparing a series of 3-(3-alkylcarbamoyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-1-yl)propanoic acids. A comparative analysis was carried out on the analgesic and diuretic properties of these compounds and their synthetic precursors, namely, the corresponding 1-(2-cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamides.

  DOI：

  10.1007/s10593-013-1213-5

文献信息

• 4-Hydroxy-2-quinolones. 221.* Synthesis, structure, and biological activity of 3-(3-(alkylcarbamoyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-1-yl)propanoic acids
  作者：I. V. Ukrainets、K. V. Andreeva、O. V. Gorokhova、V. N. Kravchenko

  DOI：10.1007/s10593-013-1213-5

  日期：2013.3

  A simple method is proposed and used for preparing a series of 3-(3-alkylcarbamoyl-4-hydroxy-2-oxo-1,2-dihydroquinolin-1-yl)propanoic acids. A comparative analysis was carried out on the analgesic and diuretic properties of these compounds and their synthetic precursors, namely, the corresponding 1-(2-cyanoethyl)-4-hydroxy-2-oxo-1,2-dihydroquinoline-3-carboxamides.