(1-(5-isopropyl-2-methyl phenoxy)-3-(N-2-dehydroxy benzyl-N-((pyridine-2-yl)amino))propan-2-ol)chloronickel(II) | 1352413-45-6

• 英文名称: (1-(5-isopropyl-2-methyl phenoxy)-3-(N-2-dehydroxy benzyl-N-((pyridine-2-yl)amino))propan-2-ol)chloronickel(II)
• CAS: 1352413-45-6
• 化学式: C₂₆H₃₁ClN₂NiO₃
• 分子量: 513.687
• InChiKey: DNKUWIHGHGMBGQ-UHFFFAOYSA-L

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  nickel(II) chloride hexahydrate 、 1-(5-isopropyl-2-methylphenoxy)-3-(N-(2-hydroxybenzyl)-N-(pyridine-2-ylmethyl)amino)propan-2-ol 在 Et₃N 作用下， 以 甲醇 为溶剂， 以70%的产率得到(1-(5-isopropyl-2-methyl phenoxy)-3-(N-2-dehydroxy benzyl-N-((pyridine-2-yl)amino))propan-2-ol)chloronickel(II)
  参考文献：
  名称：

  Cu(II), Ni(II), Zn(II) and Fe(III) complexes containing a N2O2 donor ligand: Synthesis, characterization, DNA cleavage studies and crystal structure of [Cu(HL)Cl]

  摘要：

  A polydentate ligand, H2L ''[1-(5-isopropyl-2-methyl phenoxy)-3-(N-2-hydroxy benzyl-N-((pyridine-2yl)amino) propan-2-ol]'', containing a N2O2 donor moiety was synthesized by refluxing 2-((5-isopropyl-2-methylphenoxy)methyl)oxirane and HBPA (N-(2-hydroxybenzyI)-N-(2-Pyridylmethyl)amine). This synthesized ligand was used for the preparation of complexes with different metal ions, viz. [Cu(HL)Cl] (1), [Ni(HL)Cl] (2), [Zn(HL)Cl] (3) and [Fe(HL)Cl-2] (4). The ligand and metal complexes were characterized by H-1 NMR, mass, ESI-MS, elemental analysis, IR. UV-Vis and electron paramagnetic resonance (EPR) spectroscopy. The crystal structure for one of the complexes, [Cu(HL)Cl], was solved from the X-ray crystallography data. The structure of the complex, based on the trigonality index tau, suggests an intermediate geometry between square pyramidal (sp) and trigonal bipyramidal (tb). Both the ligand and the metal complexes show oxidative cleavage of plasmid DNA (pBR322) without addition of any exogenous agent, even at a concentration of 5 mu M. The binding constants for these compounds were found to be in the range 5.33-0.065 x 10(5) M-1. (C) 2011 Elsevier Ltd. All rights reserved.

  DOI：

  10.1016/j.poly.2011.06.032