1-(2,4-dichlorobenzyl)-2-((1-(2,4-dichlorobenzyl)-1H-imidazol-2-yl)methyl)-1H-imidazole | 737001-59-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 1-(2,4-dichlorobenzyl)-2-((1-(2,4-dichlorobenzyl)-1H-imidazol-2-yl)methyl)-1H-imidazole
• 英文别名: 1-[(2,4-Dichlorophenyl)methyl]-2-[[1-[(2,4-dichlorophenyl)methyl]imidazol-2-yl]methyl]imidazole
• CAS: 737001-59-1
• 化学式: C₂₁H₁₆Cl₄N₄
• 分子量: 466.197
• InChiKey: UYBLKRRMKFLVJJ-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  5.8
• 重原子数：
  29
• 可旋转键数：
  6
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.14
• 拓扑面积：
  35.6
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  zinc perchlorate 、 1-(2,4-dichlorobenzyl)-2-((1-(2,4-dichlorobenzyl)-1H-imidazol-2-yl)methyl)-1H-imidazole 以 甲醇 为溶剂， 以65%的产率得到[Zn(1-(2,4-dichlorobenzyl)-2-((1-(2,4-dichlorobenzyl)-1H-imidazol-2-yl)methyl)-1H-imidazole)2](ClO4)2
  参考文献：
  名称：

  Synthesis and structure of Mn(II), Cu(II) and Zn(II) complexes containing bis-imidazole ligands

  摘要：

  A family of bis-imidazole ligands based on the parent bis(imidazol-2-yl)methane structure, and which can mimic multi-histidine coordination in biological systems, have been complexed to Mn(II), Cu(II) and Zn(11) centres. Five complexes were characterised by X-ray crystallography. A common structural feature of the ligands is that the two imidazole rings, which have a single spacer tetrahedral carbon atom between them, form stable, six-membered N,N' chelate rings with the metals. (C) 2004 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2004.04.015