N-(2-pivaloyloxyethyl)-N-(pivaloyloxymethyl)-p-toluenesulfonamide | 1006726-14-2

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: N-(2-pivaloyloxyethyl)-N-(pivaloyloxymethyl)-p-toluenesulfonamide
• 英文别名: 2-[2,2-Dimethylpropanoyloxymethyl-(4-methylphenyl)sulfonylamino]ethyl 2,2-dimethylpropanoate；2-[2,2-dimethylpropanoyloxymethyl-(4-methylphenyl)sulfonylamino]ethyl 2,2-dimethylpropanoate
• CAS: 1006726-14-2
• 化学式: C₂₀H₃₁NO₆S
• 分子量: 413.535
• InChiKey: UMZQHZKSVHSZEL-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.1
• 重原子数：
  28
• 可旋转键数：
  11
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.6
• 拓扑面积：
  98.4
• 氢给体数：
  0
• 氢受体数：
  7

反应信息

• 作为反应物：
  描述：

  N-(2-pivaloyloxyethyl)-N-(pivaloyloxymethyl)-p-toluenesulfonamide 在 ammonium hydroxide 、 N,O-双三甲硅基乙酰胺 作用下， 以 甲醇 、 1,2-二氯乙烷 为溶剂， 反应 169.25h， 生成 2-amino-9-[N-(2-pivaloyloxyethyl)-p-toluenesulfonylaminomethyl]-9H-purin-6-one
  参考文献：
  名称：

  Synthesis and Antiviral Properties of Aza-Analogues ofAcyclovir

  摘要：

  Aza-analogues of Acyclovir were obtained from N-(2-pivaloyloxyethyl)-N-(pivaloyloxymethyl)p-toluenesulfonamide via a one-pot base silylation/nucleoside coupling procedure. The antiviral activities of all aza-nucleosides in vitro against a variety of viruses were evaluated. None of these compounds displayed any specific antiviral effects.

  DOI：

  10.1080/15257770601052281
• 作为产物：
  描述：

  三甲基乙酰氯 在 吡啶 、 potassium carbonate 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 144.0h， 生成 N-(2-pivaloyloxyethyl)-N-(pivaloyloxymethyl)-p-toluenesulfonamide
  参考文献：
  名称：

  Synthesis and Antiviral Properties of Aza-Analogues ofAcyclovir

  摘要：

  Aza-analogues of Acyclovir were obtained from N-(2-pivaloyloxyethyl)-N-(pivaloyloxymethyl)p-toluenesulfonamide via a one-pot base silylation/nucleoside coupling procedure. The antiviral activities of all aza-nucleosides in vitro against a variety of viruses were evaluated. None of these compounds displayed any specific antiviral effects.

  DOI：

  10.1080/15257770601052281

文献信息

• Synthesis and Antiviral Properties of Aza-Analogues of<i>Acyclovir</i>
  作者：Mariola Koszytkowska-Stawińska、Katarzyna Kaleta、Wojciech Sas、Erik De Clercq

  DOI：10.1080/15257770601052281

  日期：2007.1

  Aza-analogues of Acyclovir were obtained from N-(2-pivaloyloxyethyl)-N-(pivaloyloxymethyl)p-toluenesulfonamide via a one-pot base silylation/nucleoside coupling procedure. The antiviral activities of all aza-nucleosides in vitro against a variety of viruses were evaluated. None of these compounds displayed any specific antiviral effects.