Methyl 1-(2-benzoyloxyethoxymethyl)-5-(4-phenyltriazol-1-yl)-1,2,4-triazole-3-carboxylate | 1028975-97-4

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑类
• 英文名称: Methyl 1-(2-benzoyloxyethoxymethyl)-5-(4-phenyltriazol-1-yl)-1,2,4-triazole-3-carboxylate
• CAS: 1028975-97-4
• 化学式: C₂₂H₂₀N₆O₅
• 分子量: 448.438
• InChiKey: ORJKTFNUXHRGFU-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3
• 重原子数：
  33
• 可旋转键数：
  11
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  123
• 氢给体数：
  0
• 氢受体数：
  9

反应信息

• 作为反应物：
  描述：

  Methyl 1-(2-benzoyloxyethoxymethyl)-5-(4-phenyltriazol-1-yl)-1,2,4-triazole-3-carboxylate 在 甲醇 、 氨 作用下， 以38.5%的产率得到1-(2-Hydroxyethoxymethyl)-5-(4-phenyltriazol-1-yl)-1,2,4-triazole-3-carboxamide
  参考文献：
  名称：

  Bitriazolyl acyclonucleosides with antiviral activity against tobacco mosaic virus

  摘要：

  Bitriazolyl acyclonucleosides were synthesized via the Huisgen reaction and then subjected to ammonolysis. The antiviral activity of these nucleosides against tobacco mosaic virus (TMV) was assessed. Like the previously described bitriazolyl compounds, these new bitriazolyl acyclonucleosides were found to show anti-TMV activity. This suggests that the bitriazolyl moieties are important structural features involved in the antiviral activity of these compounds. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.02.139
• 作为产物：
  描述：

  methyl 5-azido-1-({2-[(phenylcarbonyl)oxy]ethoxy}methyl)-1H-1,2,4-triazole-3-carboxylate 、 苯乙炔 在 copper(II) sulfate 、 sodium ascorbate 作用下， 以 四氢呋喃 为溶剂， 以44.6%的产率得到Methyl 1-(2-benzoyloxyethoxymethyl)-5-(4-phenyltriazol-1-yl)-1,2,4-triazole-3-carboxylate
  参考文献：
  名称：

  Bitriazolyl acyclonucleosides with antiviral activity against tobacco mosaic virus

  摘要：

  Bitriazolyl acyclonucleosides were synthesized via the Huisgen reaction and then subjected to ammonolysis. The antiviral activity of these nucleosides against tobacco mosaic virus (TMV) was assessed. Like the previously described bitriazolyl compounds, these new bitriazolyl acyclonucleosides were found to show anti-TMV activity. This suggests that the bitriazolyl moieties are important structural features involved in the antiviral activity of these compounds. (C) 2008 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2008.02.139