Manganese(II) and Zinc(II) metal complexes of novel bidentate formamide-based Schiff base ligand: synthesis, structural characterization, antioxidant, antibacterial, and in-silico molecular docking study Article Swipe
Vijay Kumar Juyal
,
Shweta Chand Thakuri
,
Mohit Panwar
,
Rashmi Gupta
,
Om Prakash
,
Kahkashan Perveen
,
Najat A. Bukhari
,
Viveka Nand
·
YOU?
·
· 2024
· Open Access
·
· DOI: https://doi.org/10.3389/fchem.2024.1414646
YOU?
·
· 2024
· Open Access
·
· DOI: https://doi.org/10.3389/fchem.2024.1414646
A new bidentate Schiff base ligand (C 16 H 16 Cl 2 N 4 ), condensation product of ethylene diamine and 4-chloro N-phenyl formamide, and its metal complexes [M(C 16 H 16 Cl 2 N 4 ) 2 (OAc) 2 ] (where M = Mn(II) and Zn(II)) were synthesized and characterized using various analytical and spectral techniques, including high-resolution mass spectrometry (HRMS), elemental analysis, ultraviolet–visible (UV–vis), Fourier-transform infrared (FTIR) spectroscopy, AAS, molar conductance, 1 H NMR, and powder XRD. All the compounds were non-electrolytes and nanocrystalline. The synthesized compounds were assessed for antioxidant potential by DPPH radical scavenging and FRAP assay, with BHT serving as the positive control. Inhibitory concentration at 50% inhibition (IC 50 ) values were calculated and used for comparative analysis. Furthermore, the prepared compounds were screened for antibacterial activity against two Gram-negative bacteria ( Staphylococcus aureus and Bacillus subtilis ) and two Gram-positive bacteria ( Escherichia coli and Salmonella typhi ) using disk-diffusion methods, with amikacin employed as the standard reference. The comparison of inhibition zones revealed that the complexes showed better antibacterial activity than the ligand. To gain insights into the molecular interactions underlying the antibacterial activity, the ligand and complexes were analyzed for their binding affinity with S. aureus tyrosyl–tRNA synthetase (PDB ID: 1JIL) and S. typhi cell membrane protein OmpF complex (PDB ID: 4KR4). These analyses revealed robust interactions, validating the observed antibacterial effects against the tested bacterial strains.
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- Type
- article
- Language
- en
- Landing Page
- https://doi.org/10.3389/fchem.2024.1414646
- https://www.frontiersin.org/journals/chemistry/articles/10.3389/fchem.2024.1414646/pdf
- OA Status
- gold
- Cited By
- 12
- References
- 69
- Related Works
- 10
- OpenAlex ID
- https://openalex.org/W4400837155
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- OpenAlex ID
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https://openalex.org/W4400837155Canonical identifier for this work in OpenAlex
- DOI
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https://doi.org/10.3389/fchem.2024.1414646Digital Object Identifier
- Title
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Manganese(II) and Zinc(II) metal complexes of novel bidentate formamide-based Schiff base ligand: synthesis, structural characterization, antioxidant, antibacterial, and in-silico molecular docking studyWork title
- Type
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articleOpenAlex work type
- Language
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enPrimary language
- Publication year
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2024Year of publication
- Publication date
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2024-07-19Full publication date if available
- Authors
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Vijay Kumar Juyal, Shweta Chand Thakuri, Mohit Panwar, Rashmi Gupta, Om Prakash, Kahkashan Perveen, Najat A. Bukhari, Viveka NandList of authors in order
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https://doi.org/10.3389/fchem.2024.1414646Publisher landing page
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https://www.frontiersin.org/journals/chemistry/articles/10.3389/fchem.2024.1414646/pdfDirect link to full text PDF
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YesWhether a free full text is available
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goldOpen access status per OpenAlex
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https://www.frontiersin.org/journals/chemistry/articles/10.3389/fchem.2024.1414646/pdfDirect OA link when available
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Chemistry, Schiff base, Antibacterial activity, Nuclear chemistry, Denticity, Ligand (biochemistry), Metal, Stereochemistry, Organic chemistry, Bacteria, Biochemistry, Biology, Receptor, GeneticsTop concepts (fields/topics) attached by OpenAlex
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12Total citation count in OpenAlex
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2025: 11, 2024: 1Per-year citation counts (last 5 years)
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69Number of works referenced by this work
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10Other works algorithmically related by OpenAlex
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