Design, spectral characterization, quantum chemical investigation, biological activity of nano-sized transition metal complexes of tridentate 3-mercapto-4H-1,2,4-triazol-4-yl-aminomethylphenol Schiff base ligand.

IF 2.7 3区 生物学 Q3 BIOCHEMISTRY & MOLECULAR BIOLOGY
Waleed M Alamier, Abdel-Nasser M A Alaghaz
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引用次数: 0

Abstract

A tridentate Schiff base ligand, H2MTIP, was produced by condensing salicylaldehyde with 4-amino-4H-1,2,4-triazole-3-thiol. The ligand was then used to create nanosized complexes of Pt(II), Ni(II), Cu(II), and Pd(II). The complexes have the composition [Pt/Ni/Cu/or Pd(MTIP)(H2O)], this conclusion is supported by molar conductance, magnetic moments, elemental analyses, spectral analyses. In DFT analysis, the 6-31+ g(d,p) basis set was used to fully optimize the energy with respect to the shapes of Schiff base ligand and metal complexes. Pt(II), Ni(II), Cu(II), and Pd(II) complexes have been assigned square-planar geometries. At the same time, the intense diffraction peaks in X-ray diffractograms show their crystalline features with particle sizes in the nanoscale range. The binding interaction of calf thymus DNA with these metal complexes and their insulin-like activity was examined in vitro by inhibiting α-amylase. The study investigated the in-vitro activity of several complexes and identified Pt(II) complex as the one with the highest activity. The researchers then tested this complex for in-vivo antidiabetic activity in induced diabetic rats using the STZ model, and it significantly lowered blood glucose levels. The antioxidant activity and toxicity level of Pt(II) complex were also excellent, suggesting that it could be a good candidate for further research as a possible diabetes drug.Communicated by Ramaswamy H. Sarma.

3-mercapto-4H-1,2,4-triazol-4-yl-aminomethylphenol Schiff base 配体的纳米级过渡金属配合物的设计、光谱表征、量子化学研究和生物活性。
水杨醛与 4-氨基-4H-1,2,4-三唑-3-硫醇缩合生成了三叉席夫碱配体 H2MTIP。然后利用该配体生成了铂(II)、镍(II)、铜(II)和钯(II)的纳米级配合物。这些配合物的组成为[Pt/Ni/Cu/or Pd(MTIP)(H2O)],摩尔电导、磁矩、元素分析和光谱分析都支持这一结论。在 DFT 分析中,使用 6-31+ g(d,p) 基集对希夫碱配体和金属配合物的形状进行了能量优化。铂(II)、镍(II)、铜(II)和钯(II)配合物被赋予了方形平面的几何结构。同时,X 射线衍射图中的强衍射峰显示了它们的结晶特征,颗粒大小在纳米级范围内。通过抑制α-淀粉酶,体外研究了小牛胸腺 DNA 与这些金属复合物的结合作用及其胰岛素样活性。研究调查了几种复合物的体外活性,发现铂(II)复合物的活性最高。随后,研究人员利用 STZ 模型测试了这种复合物在诱导糖尿病大鼠体内的抗糖尿病活性,结果发现它能显著降低血糖水平。铂(II)复合物的抗氧化活性和毒性水平也非常好,这表明它可以作为一种可能的糖尿病药物进行进一步研究。
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来源期刊
Journal of Biomolecular Structure & Dynamics
Journal of Biomolecular Structure & Dynamics 生物-生化与分子生物学
CiteScore
8.90
自引率
9.10%
发文量
597
审稿时长
2 months
期刊介绍: The Journal of Biomolecular Structure and Dynamics welcomes manuscripts on biological structure, dynamics, interactions and expression. The Journal is one of the leading publications in high end computational science, atomic structural biology, bioinformatics, virtual drug design, genomics and biological networks.
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