1-methyl-6-(N-phenyl-2-aminophenyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione | 1314582-34-7

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 吡啶及其衍生物
• 英文名称: 1-methyl-6-(N-phenyl-2-aminophenyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
• CAS: 1314582-34-7
• 化学式: C₂₀H₁₆N₄O₂
• 分子量: 344.373
• InChiKey: CIDQLMSPUREHPE-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.03
• 重原子数：
  26.0
• 可旋转键数：
  3.0
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.05
• 拓扑面积：
  79.78
• 氢给体数：
  2.0
• 氢受体数：
  5.0

反应信息

• 作为产物：
  描述：

  6-氨基-1-甲基尿嘧啶 、 1-苯基吲哚-3-甲醛 在 三甲基氯硅烷 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 反应 6.0h， 以33%的产率得到1-methyl-6-(N-phenyl-2-aminophenyl)pyrido[2,3-d]pyrimidine-2,4(1H,3H)-dione
  参考文献：
  名称：

  3-Acylindoles as versatile starting materials for pyridine ring annulation: synthesis of 1-deazapurine isosteres

  摘要：

  The reaction of electron-rich aminoheterocycles with 3-acyl- and 3-formylindoles results in indole ring opening and cyclocondensation to give heteroannulated pyridines, which can be regarded as purine isosteres. The transformations reported herein represent rare examples of domino reactions, which include the cleavage of an indole moiety. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.tet.2011.05.037

文献信息

• 3-Acylindoles as versatile starting materials for pyridine ring annulation: synthesis of 1-deazapurine isosteres
  作者：Ingo Knepper、Viktor O. Iaroshenko、Marcelo Vilches-Herrera、Lutz Domke、Satenik Mkrtchyan、Muhammad Zahid、Alexander Villinger、Peter Langer

  DOI：10.1016/j.tet.2011.05.037

  日期：2011.7

  The reaction of electron-rich aminoheterocycles with 3-acyl- and 3-formylindoles results in indole ring opening and cyclocondensation to give heteroannulated pyridines, which can be regarded as purine isosteres. The transformations reported herein represent rare examples of domino reactions, which include the cleavage of an indole moiety. (C) 2011 Elsevier Ltd. All rights reserved.