2,2-Bis-(4-methyl-benzyl)-N,N'-di-quinolin-8-yl-malonamide | 145600-20-0

• 分子结构分类: 有机化合物 - 苯丙烷和聚酮 - 直链 1,3-二芳基丙烷
• 英文名称: 2,2-Bis-(4-methyl-benzyl)-N,N'-di-quinolin-8-yl-malonamide
• 英文别名: 2,2-bis[(4-methylphenyl)methyl]-N,N'-di(quinolin-8-yl)propanediamide
• CAS: 145600-20-0
• 化学式: C₃₇H₃₂N₄O₂
• 分子量: 564.687
• InChiKey: ODSQJARIDHULPO-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  8.2
• 重原子数：
  43
• 可旋转键数：
  8
• 环数：
  6.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  84
• 氢给体数：
  2
• 氢受体数：
  4

反应信息

• 作为反应物：
  描述：

  copper(II) acetate monohydrate 、 2,2-Bis-(4-methyl-benzyl)-N,N'-di-quinolin-8-yl-malonamide 以 乙醇 为溶剂， 以77%的产率得到
  参考文献：
  名称：

  Role of substituents in copper(II) extraction with N,N′-bis(8-quinolyl)malonamides

  摘要：

  It has been found that substituents on N,N'-bis(8-quinolyl)malonamide play an important role in copper(II) extraction: among the substituents studied, benzyl groups dramatically increased extractability of the malonamide complex. The role of substituents is discussed on the basis of the results of titration and H-1 NMR measurements of copper(II) or nickel(II) complexes as well as copper(II)-extraction experiments. Intramolecular interactions between pi electrons of the benzyl group and the metal centre of the complex are proposed to occur.

  DOI：

  10.1039/dt9920002679
• 作为产物：
  描述：

  在 calcium sulfate 、 氢氧化钾 、 氯化亚砜 作用下， 以 乙醇 、 苯 为溶剂， 反应 5.0h， 生成 2,2-Bis-(4-methyl-benzyl)-N,N'-di-quinolin-8-yl-malonamide
  参考文献：
  名称：

  Role of substituents in copper(II) extraction with N,N′-bis(8-quinolyl)malonamides

  摘要：

  It has been found that substituents on N,N'-bis(8-quinolyl)malonamide play an important role in copper(II) extraction: among the substituents studied, benzyl groups dramatically increased extractability of the malonamide complex. The role of substituents is discussed on the basis of the results of titration and H-1 NMR measurements of copper(II) or nickel(II) complexes as well as copper(II)-extraction experiments. Intramolecular interactions between pi electrons of the benzyl group and the metal centre of the complex are proposed to occur.

  DOI：

  10.1039/dt9920002679

文献信息

• Role of substituents in copper(<scp>II</scp>) extraction with N,N′-bis(8-quinolyl)malonamides
  作者：Takuji Hirose、Kazuhisa Hiratani、Kazuyuki Kasuga、Kiyoshi Saito、Tohru Koike、Eiichi Kimura、Yoshinobu Nagawa、Hiroshi Nakanishi

  DOI：10.1039/dt9920002679

  日期：——

  It has been found that substituents on N,N'-bis(8-quinolyl)malonamide play an important role in copper(II) extraction: among the substituents studied, benzyl groups dramatically increased extractability of the malonamide complex. The role of substituents is discussed on the basis of the results of titration and H-1 NMR measurements of copper(II) or nickel(II) complexes as well as copper(II)-extraction experiments. Intramolecular interactions between pi electrons of the benzyl group and the metal centre of the complex are proposed to occur.