N-(3-(6-(cyanomethyl)-2-phenylpyrimidin-4-yl)phenyl)acetamide

• 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: N-(3-(6-(cyanomethyl)-2-phenylpyrimidin-4-yl)phenyl)acetamide
• 英文别名: N-[3-[6-(cyanomethyl)-2-phenylpyrimidin-4-yl]phenyl]acetamide
• 化学式: C₂₀H₁₆N₄O
• 分子量: 328.373
• InChiKey: LSVUMFINYYTCMQ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  2.4
• 重原子数：
  25
• 可旋转键数：
  4
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.1
• 拓扑面积：
  78.7
• 氢给体数：
  1
• 氢受体数：
  4

反应信息

• 作为产物：
  描述：

  3-乙酰胺基苯乙酮 在 potassium hydroxide 作用下， 以 N,N-二甲基甲酰胺 为溶剂， 生成 N-(3-(6-(cyanomethyl)-2-phenylpyrimidin-4-yl)phenyl)acetamide
  参考文献：
  名称：

  A Diversified Approach to the Synthesis of Highly Functionalized Novel Azines and Azoles from 2H-Pyran-2-ones

  摘要：

  One-pot regioselective synthesis of 2,6-diarylpyrimidines (4), 2,6-disubstituted pyridines (5 and 6), 5-aryl-3-cyanomethyl-1H-pyrazoles (7) through base catalyzed ring transformation of suitably functionalized 2H-pyran-2-ones by arylamidines, cyanamide, ammonium carbonate, hydrazines respectively has been developed. Our synthetic approach opened a new avenue for the regioselective synthesis of 2,6-diarylpyrimidines and 2,6-disubstituted pyridines and cyanomethylpyrazoles. The procedure is very simple, efficient and economically viable. The protocol provides an efficient methodology for the preparation of new class of medicinally useful and highly functionalized azines and azoles from single precursor 2H-pyran-2-ones.

  DOI：

  10.3987/com-12-s(n)1

文献信息

• A Diversified Approach to the Synthesis of Highly Functionalized Novel Azines and Azoles from 2H-Pyran-2-ones
  作者：Vishnu K. Tandon、Vishnu Ji Ram、Pushyamitra Mishra、Hardesh K. Maurya、Sanjay K. Gautam、Sandeep Kumar、Brijesh Kumar

  DOI：10.3987/com-12-s(n)1

  日期：——

  One-pot regioselective synthesis of 2,6-diarylpyrimidines (4), 2,6-disubstituted pyridines (5 and 6), 5-aryl-3-cyanomethyl-1H-pyrazoles (7) through base catalyzed ring transformation of suitably functionalized 2H-pyran-2-ones by arylamidines, cyanamide, ammonium carbonate, hydrazines respectively has been developed. Our synthetic approach opened a new avenue for the regioselective synthesis of 2,6-diarylpyrimidines and 2,6-disubstituted pyridines and cyanomethylpyrazoles. The procedure is very simple, efficient and economically viable. The protocol provides an efficient methodology for the preparation of new class of medicinally useful and highly functionalized azines and azoles from single precursor 2H-pyran-2-ones.