1-(2-(2-(2-methoxybenzyloxy)phenyl)-4-(4-methoxyphenyl)-6-methylpyrimidin-5-yl)ethanone | 1565837-06-0

• 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: 1-(2-(2-(2-methoxybenzyloxy)phenyl)-4-(4-methoxyphenyl)-6-methylpyrimidin-5-yl)ethanone
• 英文别名: 1-[4-(4-Methoxyphenyl)-2-[2-[(2-methoxyphenyl)methoxy]phenyl]-6-methylpyrimidin-5-yl]ethanone；1-[4-(4-methoxyphenyl)-2-[2-[(2-methoxyphenyl)methoxy]phenyl]-6-methylpyrimidin-5-yl]ethanone
• CAS: 1565837-06-0
• 化学式: C₂₈H₂₆N₂O₄
• 分子量: 454.525
• InChiKey: OJFUWBIORXEHKF-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5
• 重原子数：
  34
• 可旋转键数：
  8
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.18
• 拓扑面积：
  70.5
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为产物：
  描述：

  5-acetyl-4-(4'-methoxyphenyl)-6-methylpyrimidin-2(1H)-one 在 N,N-二甲基苯胺 、 三氯氧磷 作用下， 以 1,4-二氧六环 为溶剂， 反应 15.58h， 生成 1-(2-(2-(2-methoxybenzyloxy)phenyl)-4-(4-methoxyphenyl)-6-methylpyrimidin-5-yl)ethanone
  参考文献：
  名称：

  Efficient synthesis of diversely substituted pyrimidines by palladium catalyzed Suzuki–Miyaura coupling

  摘要：

  An efficient synthesis of 2-aryl/heteroaryl substituted pyrimidinyl ethanones 4(a-t) was developed using a palladium-catalyzed Suzuki-Miyaura coupling reaction strategy. Use of Pd(OAc)(2) in the presence of PPh3 and Na2CO3 in 1,4-dioxane solvent was found to be the most effective reaction condition. (C) 2014 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tetlet.2014.01.042

文献信息

• Efficient synthesis of diversely substituted pyrimidines by palladium catalyzed Suzuki–Miyaura coupling
  作者：Viral J. Faldu、Pratik K. Talpara、Viresh H. Shah

  DOI：10.1016/j.tetlet.2014.01.042

  日期：2014.2

  An efficient synthesis of 2-aryl/heteroaryl substituted pyrimidinyl ethanones 4(a-t) was developed using a palladium-catalyzed Suzuki-Miyaura coupling reaction strategy. Use of Pd(OAc)(2) in the presence of PPh3 and Na2CO3 in 1,4-dioxane solvent was found to be the most effective reaction condition. (C) 2014 Elsevier Ltd. All rights reserved.