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Synthesis, Characterization, Photoluminescence, Molecular Docking and Bioactivity of Zinc (II) Compounds Based on Different Substituents

机译:基于不同取代基的锌(II)化合物的合成,表征,光致发光,分子对接和生物分子

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Six new zinc(II) complexes were prepared by the reaction of ZnBr 2 or ZnI 2with 4 0 -(substituted-phenyl)-2,2 0 :6 0 ,2 00 -terpyridine compounds, bearing p-methylsulfonyl (L 1 ),p-methoxy (L 2 ) and p-methyl (L 3 ), which were characterized by elemental analysis, FT-IR, NMR andsingle crystal X-ray diffraction. The antiproliferative properties against Eca-109, A549 and Bel-7402cell lines and the cytotoxicity test on RAW-264.7 of these compounds were monitored using a CCK-8assay, and the studies indicate that the complexes show higher antiproliferative activities thancisplatin. The interactions of these complexes with CT-DNA and proteins (BSA) were studied byUV-Vis, circular dichroism (CD) and fluorescent spectroscopy, respectively. The results indicatethat the interaction of these zinc(II) complexes with CT-DNA is achieved through intercalativebinding, and their strong binding affinity to BSA is fulfilled through a static quenching mechanism.The simulation of the complexes with the CT-DNA fragment and BSA was studied by using moleculardocking software. It further validates that the complexes interact with DNA through intercalativebinding mode and that they have a strong interaction with BSA.
机译:通过ZnBr 2或ZnI 2的反应制备六种新的锌(II)络合物4 0-(取代 - 苯基)-2,2 0:6 0,2 00-吡啶化合物,携带对甲基磺酰基(L 1), P-甲氧基(L 2)和P-甲基(L 3),其特征在于元素分析,FT-IR,NMR和晶体X射线衍射。使用CCK-8Assay监测针对ECA-109,A549和BEL-7402Cell系和原始-264.7上的细胞毒性试验的抗增殖性能,研究表明,该复合物显示出较高的抗增殖活性。这些配合物与CT-DNA和蛋白质(BSA)的相互作用分别由uv-Vis,圆形二中型(CD)和荧光光谱研究。结果表明通过嵌合嵌合嵌合实现了与CT-DNA的这些锌(II)复合物的相互作用,并通过静态猝灭机理实现了对BSA的强结合亲和力。用CT-DNA片段和BSA的复合物的模拟通过使用分子池软件研究。它进一步验证了复合物通过嵌入式模糊模式与DNA相互作用,并且它们与BSA具有强烈的相互作用。

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