2-phenyl-1,3-bis[3'-aza-4'-(2'-hydroxyphenyl)-prop-4-en-1'-yl]-1,3-imidazolidine | 836601-23-1

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 唑烷类
• 英文名称: 2-phenyl-1,3-bis[3'-aza-4'-(2'-hydroxyphenyl)-prop-4-en-1'-yl]-1,3-imidazolidine
• 英文别名: 2-(2'-phenyl)-1,3-bis(3'-aza-4'-(2''-hydroxyphenyl)-prop-4-en-1'-yl)-1,3-imidazoline；2-[2-[3-[2-[(2-Hydroxyphenyl)methylideneamino]ethyl]-2-phenylimidazolidin-1-yl]ethyliminomethyl]phenol
• CAS: 836601-23-1
• 化学式: C₂₇H₃₀N₄O₂
• 分子量: 442.561
• InChiKey: ZYDNXTWHAGLXBH-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  3.5
• 重原子数：
  33
• 可旋转键数：
  9
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.26
• 拓扑面积：
  71.7
• 氢给体数：
  2
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  2-phenyl-1,3-bis[3'-aza-4'-(2'-hydroxyphenyl)-prop-4-en-1'-yl]-1,3-imidazolidine 以 水 、 N,N-二甲基甲酰胺 、 丙酮 为溶剂， 生成 [Cu2(1,4-bis(2-salicylideneaminoethyl)piperazine(-2H))(DMF)2](perchlorate)2
  参考文献：
  名称：

  通过新配体杂环咪唑烷间隔基的溶液转化获得椅子-哌嗪桥接N,N-二甲基甲酰胺配位二铜(II/II)配合物

  摘要：

  摘要 将杂环咪唑烷间隔基进行溶液转化，得到了第一个N,N-二甲基甲酰胺配位椅-哌嗪桥连二铜(II/II)配合物[Cu 2 II ( μ - L ) ( DMF ) 2 ] ( ClO 4 ) 2 。新的μ-双（三齿）配体（H2L'）。

  DOI：

  10.1016/j.inoche.2004.09.018

文献信息

• Iron(III) induced 2-phenyl imidazolidine ring hydrolysis of a new binucleating Schiff base ligand: X-ray structure of the mononuclear FeIII(NNO)2 end product
  作者：Manindranath Bera、Uday Mukhopadhyay、Debashis Ray

  DOI：10.1016/j.ica.2004.07.034

  日期：2005.1

  The reaction of triethylenetetramine, salicylaldehyde and benzaldehyde in 1:2:1 mole ratio in methanol at room temperature affords a novel t-bis(tridentate) ligand H2L' through the formation of an imidazolidine ring within the parent hexadentate precursor in a two step reaction. The ligand H2L' reacts with Fe(ClO4)(2) (.) 6H(2)O in aqueous methanol in the presence of triethylamine to form the mononuclear [(FeL)-L-III](ClO4) complex, (where L2- is the anion of the parent hexadentate H(2)saltrien ligand) after the cleavage of the imidazolidine ring. The mononuclear complex has a structure with an N4O2 donor atom set of the hexadentate ligand forming a distorted octahedral coordination geometry around the metal atom as established from a crystal structure determination. The Fe-N(imine) distances are 1.934(10) and 1.948(9) Angstrom, Fe-N(amine) distances are 2.062(8) and 2.076(9) Angstrom and Fe-O(phenol) distances are 1.864(8) and 1.872(7) Angstrom. The terminal oxygen donor atoms occupy cis positions and the remaining four nitrogen atoms (two cis amine and two trans imine) complete the coordination sphere. The mononuclear complex has a magnetic moment 1.89 mu(B) corresponding to the low-spin 3d(5) configuration. The UV-Vis spectrum of the end product, after the imidazolidine ring hydrolysis, is different from the spectrum of the initial reaction mixture containing the t-bis(tridentate) ligand H2L'. (C) 2004 Elsevier B.V. All rights reserved.