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<p>Novel 1,2,4-triazole clubbed with 1,3,4-oxadiazole motifs as efficient antimicrobial agents from N-arylsydnone as synthon</p>

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Title Statement <p>Novel 1,2,4-triazole clubbed with 1,3,4-oxadiazole motifs as efficient antimicrobial agents from N-arylsydnone as synthon</p>
 
Added Entry - Uncontrolled Name Somagond, Shipa M; Department of Studies in Chemistry, Karnatak University Dharwad – 580003, Karnataka, India
Kamble, Ravindra R; Department of Studies in Chemistry, Karnatak University Dharwad – 580003, Karnataka, India
Sudha, Belgur S; Department of Chemistry, Yuvaraja’s College, Mysore – 570005, Karnataka, India
Margankop, Sheetal B; Department of Chemistry, Government First Grade College, Paschapur -591122, Karnataka, India
Kattimani, Pramod P; Department of Chemistry, JSS Arts, Science and Commerce College, Gokak 591307, Karnataka, India
Joshi, Shrinivas D; Novel Drug Design and Discovery Laboratory, Department of Pharmaceutical Chemistry, S.E.T.’s College of Pharmacy, Dharwad -580002, Karnataka, India
 
Uncontrolled Index Term 1,3,4-Oxadiazole, Anti-fungal activity, Anti-bacterial activity, 1, 2, 4-Triazole
 
Summary, etc. <p style="text-align: justify;">1,2,4-Triazoles and 1,3,4-oxadiazoles independently are very important pharmacophores. In view of this, a new class of 1,2,4-triazole clubbed with 1,3,4-oxadiazole motifs<strong> </strong>have been prepared and characterized by IR, <sup>1</sup>H NMR, <sup>13</sup>C NMR and mass spectral analysis. Molecular docking of all the title compounds into <em>S. aureus tyrosyl-tRNA synthetase</em> (PDB: 1JIJ) and <em>lanosterol </em><em>14α-demethylase</em> complex with standard inhibitor Fluconazole (PDB: 3KHM) was performed which snugly fitted into the active site thus explaining their excellent inhibitory activity exhibiting their possible antibacterial and antifungal activity, respectively. Drug-likeliness, Drug score values and toxicity prediction analyses of all the title compounds have shown favourable values and these molecules belong to Class 4 and Class 5 categories which make them useful scaffolds. Interestingly, the compounds <strong>7h</strong>,<strong> 7i</strong>,<strong> 7k</strong>,<strong> 7u </strong>and<strong> 7v </strong>have<strong> </strong>exhibited majestic antibacterial activity. Also, these compounds have shown antifungal activity against all pathogenic fungal strains with lower MIC value ranging from 0.50 - 4.00 µg/mL.</p>
 
Publication, Distribution, Etc. Indian Journal of Chemistry (IJC)
2022-10-21 16:51:33
 
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http://op.niscair.res.in/index.php/IJC/article/view/67206
 
Data Source Entry Indian Journal of Chemistry (IJC); ##issue.vol## 61, ##issue.no## 10 (2022): Indian Journal of Chemistry-(IJC)
 
Language Note en