benzyl (4-(hydrazinecarbonyl)pyrimidin-2-yl)carbamate | 1443227-31-3

• 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: benzyl (4-(hydrazinecarbonyl)pyrimidin-2-yl)carbamate
• 英文别名: benzyl N-[4-(hydrazinecarbonyl)pyrimidin-2-yl]carbamate
• CAS: 1443227-31-3
• 化学式: C₁₃H₁₃N₅O₃
• 分子量: 287.278
• InChiKey: JCXYCJRRSSDUDE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  0.5
• 重原子数：
  21
• 可旋转键数：
  5
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.08
• 拓扑面积：
  119
• 氢给体数：
  3
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  benzyl (4-(hydrazinecarbonyl)pyrimidin-2-yl)carbamate 在 palladium 10% on activated carbon 、 ammonium acetate 、 氢气 、 溶剂黄146 作用下， 以 甲醇 为溶剂， 反应 12.67h， 生成 4-(9H-pyrido[3,4-b]indol-1-yl)pyrimidin-2-amine
  参考文献：
  名称：

  Two new approaches towards the synthesis of annomontine using Pictet–Spengler and aza-Diels–Alder reactions

  摘要：

  Two new routes were established for the synthesis of biologically active natural product annomontine utilizing Pictet-Spengler and aza-Diels-Alder reactions as key steps. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2013.05.026
• 作为产物：
  描述：

  methyl 2-(((benzyloxy)carbonyl)amino)pyrimidine-4-carboxylate 在 一水合肼 作用下， 以 四氢呋喃 为溶剂， 反应 0.33h， 以86%的产率得到benzyl (4-(hydrazinecarbonyl)pyrimidin-2-yl)carbamate
  参考文献：
  名称：

  Two new approaches towards the synthesis of annomontine using Pictet–Spengler and aza-Diels–Alder reactions

  摘要：

  Two new routes were established for the synthesis of biologically active natural product annomontine utilizing Pictet-Spengler and aza-Diels-Alder reactions as key steps. (C) 2013 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2013.05.026

文献信息

• Two new approaches towards the synthesis of annomontine using Pictet–Spengler and aza-Diels–Alder reactions
  作者：Nilesh H. Naik、Arun K. Sikder、Radhika S. Kusurkar

  DOI：10.1016/j.tetlet.2013.05.026

  日期：2013.7

  Two new routes were established for the synthesis of biologically active natural product annomontine utilizing Pictet-Spengler and aza-Diels-Alder reactions as key steps. (C) 2013 Elsevier Ltd. All rights reserved.