4-chloro-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxylic acid 2-diethylaminoethylamide | 945487-81-0

• 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: 4-chloro-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxylic acid 2-diethylaminoethylamide
• 英文别名: 4-Chloro-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxylic acid 2-(diethyl-amino)ethylamide；4-chloro-N-[2-(diethylamino)ethyl]-2-oxo-1-propylquinoline-3-carboxamide
• CAS: 945487-81-0
• 化学式: C₁₉H₂₆ClN₃O₂
• 分子量: 363.887
• InChiKey: YCTZRDFNLMMUAR-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.6
• 重原子数：
  25
• 可旋转键数：
  8
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.47
• 拓扑面积：
  52.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  4-chloro-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxylic acid 2-diethylaminoethylamide 在 盐酸 作用下， 以 异丙醇 为溶剂， 以94%的产率得到4-chloro-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxylic acid 2-(diethylamino)ethylamide hydrochloride
  参考文献：
  名称：

  4-hydroxy-2-quinolones. 178*. irreversible chemical modification of chinoxicaine at the position 4 of the quinolone ring

  摘要：

  While continuing our investigation in improving the pharmaceutical activities of the local anesthetic Chinoxicaine we have studied the irreversible replacement of its 4-OH group for bioisosteric fragments. For this purpose the synthesis of a series of 4-R-2-oxo-1,2-dihydroquinoline-3-carboxylic acids 2-(diethylamino) ethylamide hydrochlorides has been carried out. The experimental data of the local anesthetic properties of the compounds obtained are given and discussed.

  DOI：

  10.1007/s10593-010-0593-z
• 作为产物：
  描述：

  4-chloro-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxylic acid 在 氯化亚砜 、 三乙胺 作用下， 以 二氯甲烷 、 丙酮 为溶剂， 反应 3.0h， 生成 4-chloro-2-oxo-1-propyl-1,2-dihydroquinoline-3-carboxylic acid 2-diethylaminoethylamide
  参考文献：
  名称：

  4-Hydroxy-2-quinolones. 93. Synthesis and biological properties of 2-hydroxy-4-imino-1,4-dihydroquinoline-3-carboxylic acid N-R-amides

  摘要：

  DOI：

  10.1007/s10593-006-0114-2

文献信息

• 4-hydroxy-2-quinolones. 178*. irreversible chemical modification of chinoxicaine at the position 4 of the quinolone ring
  作者：I. V. Ukrainets、A. A. Tkach、V. V. Kravtsova、V. I. Mamchur、E. Yu. Kovalenko

  DOI：10.1007/s10593-010-0593-z

  日期：2010.11

  While continuing our investigation in improving the pharmaceutical activities of the local anesthetic Chinoxicaine we have studied the irreversible replacement of its 4-OH group for bioisosteric fragments. For this purpose the synthesis of a series of 4-R-2-oxo-1,2-dihydroquinoline-3-carboxylic acids 2-(diethylamino) ethylamide hydrochlorides has been carried out. The experimental data of the local anesthetic properties of the compounds obtained are given and discussed.
• 4-Hydroxy-2-quinolones. 93. Synthesis and biological properties of 2-hydroxy-4-imino-1,4-dihydroquinoline-3-carboxylic acid N-R-amides
  作者：I. V. Ukrainets、L. V. Sidorenko、O. V. Gorokhova、N. A. Jaradat

  DOI：10.1007/s10593-006-0114-2

  日期：2006.4