methyl 5-(2-methoxyethyl)-1-(quinoxalin-2-yl)-1H-1,2,4-triazole-3-carboxylate | 1263816-15-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二氮杂萘
• 英文名称: methyl 5-(2-methoxyethyl)-1-(quinoxalin-2-yl)-1H-1,2,4-triazole-3-carboxylate
• 英文别名: Methyl 5-(2-methoxyethyl)-1-quinoxalin-2-yl-1,2,4-triazole-3-carboxylate
• CAS: 1263816-15-4
• 化学式: C₁₅H₁₅N₅O₃
• 分子量: 313.316
• InChiKey: SBMHORNTLWWNJD-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.6
• 重原子数：
  23
• 可旋转键数：
  6
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.27
• 拓扑面积：
  92
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为产物：
  描述：

  2-肼基喹喔啉 、 在 溶剂黄146 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 3.0h， 生成 methyl 5-(2-methoxyethyl)-1-(quinoxalin-2-yl)-1H-1,2,4-triazole-3-carboxylate
  参考文献：
  名称：

  Rapid Synthesis of 1,3,5-Substituted 1,2,4-Triazoles from Carboxylic Acids, Amidines, and Hydrazines

  摘要：

  A general method for the synthesis of 1,3,5-trisubstituted 1,2,4-triazoles has been developed from reaction of carboxylic acids, primary amidines, and monosubstituted hydrazines. This highly regioselective and one-pot process provides rapid access to highly diverse triazoles.

  DOI：

  10.1021/jo1023393

文献信息

• Rapid Synthesis of 1,3,5-Substituted 1,2,4-Triazoles from Carboxylic Acids, Amidines, and Hydrazines
  作者：Georgette M. Castanedo、Pamela S. Seng、Nicole Blaquiere、Sean Trapp、Steven T. Staben

  DOI：10.1021/jo1023393

  日期：2011.2.18

  A general method for the synthesis of 1,3,5-trisubstituted 1,2,4-triazoles has been developed from reaction of carboxylic acids, primary amidines, and monosubstituted hydrazines. This highly regioselective and one-pot process provides rapid access to highly diverse triazoles.