(5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl) N-methyl-N-propylcarbamate | 182622-16-8

• 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-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl) N-methyl-N-propylcarbamate
• CAS: 182622-16-8
• 化学式: C₁₃H₁₅N₃O₄
• 分子量: 277.28
• InChiKey: RZOHLRUPUKLRPH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.6
• 重原子数：
  20
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.31
• 拓扑面积：
  81
• 氢给体数：
  0
• 氢受体数：
  5

反应信息

• 作为反应物：
  描述：

  (5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl) N-methyl-N-propylcarbamate 在 亚磷酸三乙酯 作用下， 以 neat (no solvent) 为溶剂， 以58%的产率得到4-phenyl-1,2,5-oxadiazol-3-yl methylpropylcarbamate
  参考文献：
  名称：

  Utilization of wieland furoxan synthesis for preparation of 4-aryl-1,2,5-oxadiazole-3-yl carbamate derivatives having potent anti-HIV activity

  摘要：

  The classical Wieland furoxan synthesis was reinvestigated and this procedure was applied to the preparation of 4-aryl-1,2,5-oxadiazole-3-yl N,N-dialkylcarbamate derivatives, which were found to exhibit potent anti-HIV-1 activity. Copyright (C) 1996 Elsevier Science Ltd.

  DOI：

  10.1016/0960-894x(96)00355-1
• 作为产物：
  描述：

  4-nitro-3-phenylfuroxan 在 sodium hydroxide 、 sodium hydride 作用下， 以 四氢呋喃 为溶剂， 生成 (5-oxido-4-phenyl-1,2,5-oxadiazol-5-ium-3-yl) N-methyl-N-propylcarbamate
  参考文献：
  名称：

  Utilization of wieland furoxan synthesis for preparation of 4-aryl-1,2,5-oxadiazole-3-yl carbamate derivatives having potent anti-HIV activity

  摘要：

  The classical Wieland furoxan synthesis was reinvestigated and this procedure was applied to the preparation of 4-aryl-1,2,5-oxadiazole-3-yl N,N-dialkylcarbamate derivatives, which were found to exhibit potent anti-HIV-1 activity. Copyright (C) 1996 Elsevier Science Ltd.

  DOI：

  10.1016/0960-894x(96)00355-1