Design, synthesis, spectral characterization, multiple-biological activities, docking and in silico ADMET studies of thiazolidinones
A series of novel thiazolidinones (5a-5i) are synthesized and characterized by FT-IR, 1H NMR and 13C NMR spectral studies. Docking studies were carried out for the synthesised compound using the protein PDB Code 1HNY, 1VMP and 3A4A and it proved that all the synthesised compounds exhibit better bind...
| Main Authors: | , |
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| Format: | Article |
| Language: | English |
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Elsevier
2023-01-01
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| Series: | Results in Chemistry |
| Subjects: | |
| Online Access: | http://www.sciencedirect.com/science/article/pii/S2211715623001005 |
| _version_ | 1827920674195243008 |
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| author | Subramaniyan Ramkumar Rajalakshmi Ramarajan |
| author_facet | Subramaniyan Ramkumar Rajalakshmi Ramarajan |
| author_sort | Subramaniyan Ramkumar |
| collection | DOAJ |
| description | A series of novel thiazolidinones (5a-5i) are synthesized and characterized by FT-IR, 1H NMR and 13C NMR spectral studies. Docking studies were carried out for the synthesised compound using the protein PDB Code 1HNY, 1VMP and 3A4A and it proved that all the synthesised compounds exhibit better binding affinity in all the above said proteins. Based on the docking results of all the newly synthesized compounds are screened for their anti-diabetic, anti-inflammatory and anti-oxidant activities. The synthesized compounds showed a very good potent activity towards anti-diabetic and anti-inflammatory properties compared with standard and exhibit moderate anti-oxidant activity than standard. Furthermore, to analysis the physiochemical and pharmacokinetic features of the compounds (5a-5i) are analysed using the SwissADME online application. |
| first_indexed | 2024-03-13T04:13:55Z |
| format | Article |
| id | doaj.art-bfb92d081b424b96803f5d90a7529b82 |
| institution | Directory Open Access Journal |
| issn | 2211-7156 |
| language | English |
| last_indexed | 2024-03-13T04:13:55Z |
| publishDate | 2023-01-01 |
| publisher | Elsevier |
| record_format | Article |
| series | Results in Chemistry |
| spelling | doaj.art-bfb92d081b424b96803f5d90a7529b822023-06-21T06:52:18ZengElsevierResults in Chemistry2211-71562023-01-015100861Design, synthesis, spectral characterization, multiple-biological activities, docking and in silico ADMET studies of thiazolidinonesSubramaniyan Ramkumar0Rajalakshmi Ramarajan1Department of Chemistry, Annamalai University, Annamalai Nagar, Chidambaram, Tamil Nadu 608 002, IndiaCorresponding author.; Department of Chemistry, Annamalai University, Annamalai Nagar, Chidambaram, Tamil Nadu 608 002, IndiaA series of novel thiazolidinones (5a-5i) are synthesized and characterized by FT-IR, 1H NMR and 13C NMR spectral studies. Docking studies were carried out for the synthesised compound using the protein PDB Code 1HNY, 1VMP and 3A4A and it proved that all the synthesised compounds exhibit better binding affinity in all the above said proteins. Based on the docking results of all the newly synthesized compounds are screened for their anti-diabetic, anti-inflammatory and anti-oxidant activities. The synthesized compounds showed a very good potent activity towards anti-diabetic and anti-inflammatory properties compared with standard and exhibit moderate anti-oxidant activity than standard. Furthermore, to analysis the physiochemical and pharmacokinetic features of the compounds (5a-5i) are analysed using the SwissADME online application.http://www.sciencedirect.com/science/article/pii/S2211715623001005ThiazolidinonesAnti-diabeticAnti-inflammatoryAnti-oxidantMolecular dockingInsilico ADMET |
| spellingShingle | Subramaniyan Ramkumar Rajalakshmi Ramarajan Design, synthesis, spectral characterization, multiple-biological activities, docking and in silico ADMET studies of thiazolidinones Results in Chemistry Thiazolidinones Anti-diabetic Anti-inflammatory Anti-oxidant Molecular docking Insilico ADMET |
| title | Design, synthesis, spectral characterization, multiple-biological activities, docking and in silico ADMET studies of thiazolidinones |
| title_full | Design, synthesis, spectral characterization, multiple-biological activities, docking and in silico ADMET studies of thiazolidinones |
| title_fullStr | Design, synthesis, spectral characterization, multiple-biological activities, docking and in silico ADMET studies of thiazolidinones |
| title_full_unstemmed | Design, synthesis, spectral characterization, multiple-biological activities, docking and in silico ADMET studies of thiazolidinones |
| title_short | Design, synthesis, spectral characterization, multiple-biological activities, docking and in silico ADMET studies of thiazolidinones |
| title_sort | design synthesis spectral characterization multiple biological activities docking and in silico admet studies of thiazolidinones |
| topic | Thiazolidinones Anti-diabetic Anti-inflammatory Anti-oxidant Molecular docking Insilico ADMET |
| url | http://www.sciencedirect.com/science/article/pii/S2211715623001005 |
| work_keys_str_mv | AT subramaniyanramkumar designsynthesisspectralcharacterizationmultiplebiologicalactivitiesdockingandinsilicoadmetstudiesofthiazolidinones AT rajalakshmiramarajan designsynthesisspectralcharacterizationmultiplebiologicalactivitiesdockingandinsilicoadmetstudiesofthiazolidinones |