N-({2-[(6-chloro-4-phenyl-2-quinazolinyl)methyl]phenyl}methylidene)(phenyl)methanamine | 301306-32-1

• 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: N-({2-[(6-chloro-4-phenyl-2-quinazolinyl)methyl]phenyl}methylidene)(phenyl)methanamine
• 英文别名: N-benzyl-1-[2-[(6-chloro-4-phenylquinazolin-2-yl)methyl]phenyl]methanimine
• CAS: 301306-32-1
• 化学式: C₂₉H₂₂ClN₃
• 分子量: 447.967
• InChiKey: JDFNNJQELJCXGZ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  7
• 重原子数：
  33
• 可旋转键数：
  6
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.07
• 拓扑面积：
  38.1
• 氢给体数：
  0
• 氢受体数：
  3

反应信息

• 作为产物：
  描述：

  3-chloro-5-phenylisoquino[2,3-a]quinazolin-13-ium perchlorate 、 苄胺 以63%的产率得到N-({2-[(6-chloro-4-phenyl-2-quinazolinyl)methyl]phenyl}methylidene)(phenyl)methanamine
  参考文献：
  名称：

  Condensed isoquinolines 29. Oxidation reactions of 5-aryl-7,12-dihydroisoquino[2,3-a]quinazolinium salts

  摘要：

  5-Aryl-7,12-dihydroisoquino[2,3-a]quinazolinium perchlorates are readily oxidized by atmospheric oxygen to form the products of oxidative coupling 5,5'-bis(aryl)-3,3'-dihalo[7,7']bi[isoquino-[2,3-a]quinazoline-13,13'-diylium perchlorates. Heating 3-chloro-5-phenyl-7,12-dihydroisoquino-[2,3-a]quinazolinium perchlorate in nitrobenzene gives the 3-chloro-5-phenylisoquino[2,3-a]quinazolin-13-ium perchlorate. The aromatic 5-arylisoquino[2,3-a]quinazoline derivatives obtained react with nucleophilic reagents to form addition products at the C-12 atom.

  DOI：

  10.1007/s10593-008-0049-x

文献信息

• Condensed isoquinolines 29. Oxidation reactions of 5-aryl-7,12-dihydroisoquino[2,3-a]quinazolinium salts
  作者：L. M. Potikha、V. M. Kisil、A. V. Turov、V. A. Kovtunenko

  DOI：10.1007/s10593-008-0049-x

  日期：2008.3

  5-Aryl-7,12-dihydroisoquino[2,3-a]quinazolinium perchlorates are readily oxidized by atmospheric oxygen to form the products of oxidative coupling 5,5'-bis(aryl)-3,3'-dihalo[7,7']bi[isoquino-[2,3-a]quinazoline-13,13'-diylium perchlorates. Heating 3-chloro-5-phenyl-7,12-dihydroisoquino-[2,3-a]quinazolinium perchlorate in nitrobenzene gives the 3-chloro-5-phenylisoquino[2,3-a]quinazolin-13-ium perchlorate. The aromatic 5-arylisoquino[2,3-a]quinazoline derivatives obtained react with nucleophilic reagents to form addition products at the C-12 atom.