5-(2-methoxyphenyl)-1-[(2-hydroxyethoxy)methyl]-1,2,4-triazole-3-carboxamide

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: 5-(2-methoxyphenyl)-1-[(2-hydroxyethoxy)methyl]-1,2,4-triazole-3-carboxamide
• 英文别名: 1-(2-Hydroxyethoxymethyl)-5-(2-methoxyphenyl)-1,2,4-triazole-3-carboxamide；1-(2-hydroxyethoxymethyl)-5-(2-methoxyphenyl)-1,2,4-triazole-3-carboxamide
• 化学式: C₁₃H₁₆N₄O₄
• 分子量: 292.294
• InChiKey: AAJFDQFLZQRRJA-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0
• 重原子数：
  21
• 可旋转键数：
  7
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  113
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  methyl 1-((2-acetoxyethoxy)methyl)-5-bromo-1H-1,2,4-triazole-3-carboxylate 在 四(三苯基膦)钯 氨 、 lithium carbonate 作用下， 以 1,4-二氧六环 、 甲醇 、 水 为溶剂， 反应 48.25h， 生成 5-(2-methoxyphenyl)-1-[(2-hydroxyethoxy)methyl]-1,2,4-triazole-3-carboxamide
  参考文献：
  名称：

  Direct synthesis of 5-aryltriazole acyclonucleosides via Suzuki coupling in aqueous solution

  摘要：

  5-Aryltriazole acyclonucleosides with various aromatic groups on the triazole ring were synthesized via the Suzuki coupling reaction in aqueous solution and promoted by microwave irradiation. Careful optimization of the reaction conditions led in good to excellent yields to the Suzuki products, while the cyclization side-reaction could be completely suppressed. (c) 2007 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2007.01.154

文献信息

• Direct synthesis of 5-aryltriazole acyclonucleosides via Suzuki coupling in aqueous solution
  作者：Ruizhi Zhu、Fanqi Qu、Gilles Quéléver、Ling Peng

  DOI：10.1016/j.tetlet.2007.01.154

  日期：2007.3

  5-Aryltriazole acyclonucleosides with various aromatic groups on the triazole ring were synthesized via the Suzuki coupling reaction in aqueous solution and promoted by microwave irradiation. Careful optimization of the reaction conditions led in good to excellent yields to the Suzuki products, while the cyclization side-reaction could be completely suppressed. (c) 2007 Elsevier Ltd. All rights reserved.