tert-butyl allyl(5-allyl-2,6-dichloropyrimidin-4-yl)carbamate | 1421698-50-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 二嗪类
• 英文名称: tert-butyl allyl(5-allyl-2,6-dichloropyrimidin-4-yl)carbamate
• CAS: 1421698-50-1
• 化学式: C₁₅H₁₉Cl₂N₃O₂
• 分子量: 344.241
• InChiKey: QAVBVXJNPXCBRV-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.44
• 重原子数：
  22.0
• 可旋转键数：
  5.0
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.4
• 拓扑面积：
  55.32
• 氢给体数：
  0.0
• 氢受体数：
  4.0

反应信息

• 作为反应物：
  描述：

  tert-butyl allyl(5-allyl-2,6-dichloropyrimidin-4-yl)carbamate 在 RuCl2(1,3-dimesityl-imidazolidin-2-yl)(PCy3)(=CHPh) 作用下， 以 二氯甲烷 为溶剂， 生成
  参考文献：
  名称：

  A ring-closing metathesis approach to heterocycle-fused azepines

  摘要：

  Heterocycle-fused azepines, an important class of molecular scaffold, are readily synthesised through the ruthenium-catalysed ring-closing metathesis reaction. Although benzo-fused azepines are well documented, heterocycle-fused examples are poorly developed. Herein, a range of five- and six-membered heterocycle-fused azepines are investigated, allowing access to a series of pharmaceutically interesting products. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.12.042
• 作为产物：
  描述：

  5-烯丙基-2,4,6-三氯嘧啶 在 4-二甲氨基吡啶 、 N,N-二异丙基乙胺 作用下， 以 乙腈 为溶剂， 反应 20.0h， 生成 tert-butyl allyl(5-allyl-2,6-dichloropyrimidin-4-yl)carbamate
  参考文献：
  名称：

  A ring-closing metathesis approach to heterocycle-fused azepines

  摘要：

  Heterocycle-fused azepines, an important class of molecular scaffold, are readily synthesised through the ruthenium-catalysed ring-closing metathesis reaction. Although benzo-fused azepines are well documented, heterocycle-fused examples are poorly developed. Herein, a range of five- and six-membered heterocycle-fused azepines are investigated, allowing access to a series of pharmaceutically interesting products. (C) 2012 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2012.12.042