5-Acetyl-6-(4-methoxyphenyl)-3,4-dimethyl-1,6-dihydropyrimidin-2-one | 359451-58-4

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯酚醚
• 英文名称: 5-Acetyl-6-(4-methoxyphenyl)-3,4-dimethyl-1,6-dihydropyrimidin-2-one
• CAS: 359451-58-4
• 化学式: C₁₅H₁₈N₂O₃
• 分子量: 274.32
• InChiKey: MYKWXYLROCNTSO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1
• 重原子数：
  20
• 可旋转键数：
  3
• 环数：
  2.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  58.6
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  5-Acetyl-6-(4-methoxyphenyl)-3,4-dimethyl-1,6-dihydropyrimidin-2-one 在 TiO₂ anatase nanoparticles 作用下， 以 乙腈 为溶剂， 反应 2.0h， 生成
  参考文献：
  名称：

  Substituent effect in photocatalytic oxidation of 2-oxo-1,2,3,4-tetrahydropyrimidines using TiO2 nanoparticles

  摘要：

  The semiconductor-sensitized oxidation of various 1-, 4- and 5-substituted 2-oxo-1,2,3,4-tetrahydropyrimidines was carried out in acetonitrile using TiO2 anatase nanoparticles. The aims of this study were to elucidate the effects of the nature of the substituents on the 1-, 4- and 5-positions of the heterocyclic ring, the type of the photocatalyst and the nature of solvent on the rate of reaction. The proposed electron-transfer mechanism is supported by the experimental results and also by the computational studies. (C) 2012 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.molcata.2011.12.026

文献信息

• Convergent assembly of structurally diverse quinazolines
  作者：Abel Crespo、Alberto Coelho、Paula M. Diz、Franco Fernández、Hector Novoa de Armas、Eddy Sotelo

  DOI：10.1039/c0ob00608d

  日期：——

  A convergent and versatile Vilsmeier–Haack-based carbo-annulation strategy that exhibits an unusually elevated bond-forming efficiency has been developed. By virtue of its innovative approach, structure economy and simple execution conditions the methodology reported here constitutes a very attractive protocol that enables the rapid assembly of structurally diverse quinazoline chemotypes.

  我们开发出了一种基于 Vilsmeier-Haack 的聚合且多功能的碳水化合物annulation 策略，该策略具有异常高的成键效率。凭借其创新的方法、结构经济性和简单的执行条件，本文所报道的方法构成了一种极具吸引力的方案，可快速组装出结构多样的喹唑啉化学型。