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1.
Artigo em Inglês | MEDLINE | ID: mdl-24820326

RESUMO

Metal complexes of Zn(II), Cd(II), Ni(II), Cu(II), Fe(III), Co(II), Mn(II) Hg(II), and Ag(I) have been synthesized from Schiff base ligand, prepared by the condensation of 3,4-(methylenedioxy)aniline and 5-bromo salicylaldehyde. All the compounds have been characterized by using elemental analysis, molar conductance, FT-IR, UV-Vis, (1)H NMR, (13)C NMR, mass spectra, powder XRD and thermal analysis (TG/DTA) technique. The elemental analysis suggests the stoichiometry to be 1:1 (metal:ligand). The FT-IR, (1)H NMR, (13)C NMR and UV-Vis spectral data suggest that the ligand coordinate to the metal atom by imino nitrogen and phenolic oxygen as bidentate manner. Mass spectral data further support the molecular mass of the compounds and their structure. Powder XRD indicates the crystalline state and morphology of the ligand and its metal complexes. The thermal behaviors of the complexes prove the presence of lattice as well as coordinated water molecules in the complexes. Melting point supports the thermal stability of all the compounds. The in vitro antimicrobial effects of the synthesized compounds were tested against five bacterial and three fungal species by well diffusion method. Antioxidant activities have also been performed for all the compounds. Metal complexes show more biological activity than the Schiff base.


Assuntos
Aldeídos/química , Compostos de Anilina/química , Anti-Infecciosos/química , Antioxidantes/química , Complexos de Coordenação/química , Bases de Schiff/química , Aldeídos/farmacologia , Compostos de Anilina/farmacologia , Anti-Infecciosos/farmacologia , Antioxidantes/farmacologia , Bactérias/efeitos dos fármacos , Infecções Bacterianas/tratamento farmacológico , Complexos de Coordenação/farmacologia , Fungos/efeitos dos fármacos , Humanos , Ligantes , Espectroscopia de Ressonância Magnética , Metais Pesados/química , Metais Pesados/farmacologia , Testes de Sensibilidade Microbiana , Micoses/tratamento farmacológico , Bases de Schiff/farmacologia , Espectrofotometria Ultravioleta , Espectroscopia de Infravermelho com Transformada de Fourier
2.
Spectrochim Acta A Mol Biomol Spectrosc ; 129: 429-37, 2014 Aug 14.
Artigo em Inglês | MEDLINE | ID: mdl-24747930

RESUMO

2-(Thiophen-2-yl)-1-((thiophen-2-yl)methyl)-1H-1,3-benzodiazole (HL) is synthesized and characterized by elemental analysis, UV-Vis, FT-IR, (1)H, (13)C NMR, mass spectra, scanning electron microscope (SEM) and single crystal X-ray diffraction. The crystal structure is stabilized by intermolecular CH⋯N and CH⋯π interactions. The molecular structure is also optimized at the B3LYP/6-31G level using density functional theory (DFT). The structural parameters from the theory are nearer to those of crystal, the calculated total energy of coordination is -1522.814a.u. The energy of HOMO-LUMO and the energy gap are -0.20718, -0.04314, 0.16404a.u, respectively. All data obtained from the spectral studies support the structural properties of the compound HL. The benzimidazole ring is essentially planar. The in vitro biological screening effects of the synthesized compound is tested against four bacterial and four fungal strains by well diffusion method. Antioxidant property and DNA binding behaviour of the compound has been investigated using spectrophotometric method.


Assuntos
Anti-Infecciosos/química , Antioxidantes/química , Derivados de Benzeno/química , DNA/metabolismo , Tiofenos/química , Anti-Infecciosos/síntese química , Anti-Infecciosos/farmacologia , Antioxidantes/síntese química , Antioxidantes/farmacologia , Bactérias/efeitos dos fármacos , Infecções Bacterianas/tratamento farmacológico , Derivados de Benzeno/síntese química , Derivados de Benzeno/farmacologia , Cristalografia por Raios X , Fungos/efeitos dos fármacos , Humanos , Modelos Moleculares , Micoses/tratamento farmacológico , Análise Espectral , Tiofenos/síntese química , Tiofenos/farmacologia
3.
Spectrochim Acta A Mol Biomol Spectrosc ; 125: 104-13, 2014 May 05.
Artigo em Inglês | MEDLINE | ID: mdl-24531110

RESUMO

Metal complexes of Zn(II), Cd(II), Ni(II), Cu(II), and Fe(III) have been synthesized from the Schiff base ligand derived by the condensation of 3,4-(methylenedioxy)aniline and 3-ethoxy salicylaldehyde. The compounds have been characterized by using elemental analysis, molar conductance, IR, UV-Visible, (1)H NMR, (13)C NMR, mass spectra and thermal analysis (TG/DTA). The elemental analysis suggests the stoichiometry to be 1:1 (metal:ligand). The IR, (1)H NMR, (13)C NMR and UV-Visible spectral data suggest that the ligand coordinate to the metal atom by imino nitrogen and phenolic oxygen as bidentate manner. The mass spectral data also strengthen the formation of the metal complexes. The thermal behaviors of the complexes prove the presence of lattice as well as coordinated water molecules in the complexes. The in vitro biological screening effects of the synthesized compounds are tested against five bacterial species and three fungal species by well diffusion method. Antioxidant activities have also been performed for all the compounds. Metal complexes show more pronounced biological activity than the free ligand.


Assuntos
Benzodioxóis/química , Complexos de Coordenação/síntese química , Complexos de Coordenação/farmacologia , Fenóis/síntese química , Fenóis/farmacologia , Antibacterianos/farmacologia , Antifúngicos/farmacologia , Antioxidantes/farmacologia , Bactérias/efeitos dos fármacos , Complexos de Coordenação/química , Condutividade Elétrica , Fungos/efeitos dos fármacos , Ligantes , Espectroscopia de Ressonância Magnética , Espectrometria de Massas , Testes de Sensibilidade Microbiana , Peso Molecular , Fenóis/química , Bases de Schiff/química , Bases de Schiff/farmacologia , Espectrofotometria Infravermelho , Espectrofotometria Ultravioleta , Termogravimetria , Temperatura de Transição
4.
Indian J Pharm Sci ; 72(2): 216-22, 2010 Mar.
Artigo em Inglês | MEDLINE | ID: mdl-20838526

RESUMO

Some new mixed ligand complexes (1-5) of type ML'B (M(II)=Mn(II), Co(II), Ni(II), Cu(II) and Zn(II); HL'= o-vanillidene-2-aminobenzothiazole; B= 1,10-phenanthroline) and Schiff base metal complexes of types (ML(2)") (6-10) and (M(2)L") (11-15) (HL"= o-vanillidene-2-amino-N-(2-pyridyl)-benzene sulfonamide) were synthesized and characterized by elemental analysis and spectral (IR, (1)H NMR and (13)C NMR) studies. The free ligands and their metal complexes have been screened for their in vitro biological activities against bacteria, fungi and yeast. The metal complexes show more potent activities compared with Schiff base ligands.

5.
Spectrochim Acta A Mol Biomol Spectrosc ; 71(4): 1599-609, 2008 Dec 15.
Artigo em Inglês | MEDLINE | ID: mdl-18656419

RESUMO

Metal complexes are synthesized with Schiff bases derived from o-phthalaldehyde (opa) and amino acids viz., glycine (gly) l-alanine (ala), l-phenylalanine (pal). Metal ions coordinate in a tetradentate or hexadentate manner with these N(2)O(2) donor ligands, which are characterized by elemental analysis, molar conductance, magnetic moments, IR, electronic, (1)H NMR and EPR spectral studies. The elemental analysis suggests the stoichiometry to be 1:1 (metal:ligand). Based on EPR studies, spin-Hamiltonian and bonding parameters have been calculated. The g-values calculated for copper complexes at 300K and in frozen DMSO (77K) indicate the presence of the unpaired electron in the dx2-y2 orbital. The evaluated metal-ligand bonding parameters showed strong in-plane sigma- and pi-bonding. X-ray diffraction (XRD) and scanning electron micrography (SEM) analysis provide the crystalline nature and the morphology of the metal complexes. The cyclic voltammograms of the Cu(II)/Mn(II)/VO(II) complexes investigated in DMSO solution exhibit metal centered electroactivity in the potential range -1.5 to +1.5V. The electrochemical data obtained for Cu(II) complexes explains the change of structural arrangement of the ligand around Cu(II) ions. The biological activity of the complexes has been tested on eight bacteria and three fungi. Cu(II) and Ni(II) complexes show an increased activity in comparison to the controls. The metal complexes of opapal Schiff base were evaluated for their DNA cleaving activities with calf-thymus DNA (CT DNA) under aerobic conditions. Cu(II) and VO(II) complexes show more pronounced activity in presence of the oxidant.


Assuntos
DNA/química , Metais/química , Bases de Schiff/química , Alanina/química , Cobre/química , Condutividade Elétrica , Eletroquímica/métodos , Espectroscopia de Ressonância de Spin Eletrônica , Elétrons , Íons , Ligantes , Espectroscopia de Ressonância Magnética , Microscopia Eletrônica de Varredura , Espectrofotometria Infravermelho/métodos , Difração de Raios X
6.
Spectrochim Acta A Mol Biomol Spectrosc ; 71(2): 628-35, 2008 Nov 15.
Artigo em Inglês | MEDLINE | ID: mdl-18313976

RESUMO

Metal complexes of o-vanillidene-2-aminobenzothiazole have been prepared and characterized by elemental and spectral (vibrational, electronic, 1H NMR and EPR) data as well as magnetic susceptibility measurements and thermo gravimetric analysis (TG/DTA). The low molar conductance values reveal the non-electrolytic nature of these complexes. The elemental analysis suggests that the stoichiometry to be 1:2 (metal:ligand). Magnetic susceptibility data coupled with electronic spectra suggest that two ligands coordinate to each metal atom by phenolic oxygen and imino nitrogen to form high spin octahedral complex with Co(II), Mn(II) and Ni(II). The fifth and sixth position of metal ion is satisfied with water molecules. The thermal behaviour (TG/DTA) of the synthesised complexes shows that the complexes loss water molecules in the first step followed by decomposition of the ligand. Spin Hamiltonian parameters predict a distorted tetrahedral geometry for the copper complex. XRD and SEM analysis provide the crystalline nature and the morphology of the metal complexes. The in vitro biological activity of the metal chelates is tested against the Gram positive bacteria (Bacillus amyloliquifacians) and gram negative bacteria (Pseudomonas species), fungus (Aspergillus niger) and yeast (Sacchromyces cereviaceae). Most of the metal chelates exhibited higher biological activities.


Assuntos
Antibacterianos/química , Antibacterianos/farmacologia , Antifúngicos/química , Antifúngicos/farmacologia , Tiazóis/química , Elementos de Transição/química , Elétrons , Ligantes , Magnetismo , Viabilidade Microbiana/efeitos dos fármacos , Microscopia Eletrônica de Varredura , Estrutura Molecular , Bases de Schiff/química , Análise Espectral , Difração de Raios X
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