Synthesis, Characterisation, and Biological and Computational Studies of Novel Schiff Bases from Heterocyclic Molecules

Q: How can I download an article?

To download an article from SID, first log in to the site, search for the article title, and click on the 'Download Article' option.

Q: How can I download an ISI article?

To download an ISI article on SID, enter the keyword or article title in the search bar, view the relevant results, click on the desired article, and select the 'Download Article' option.

Q: How can I access the SID database?

To access the SID database, visit SID.ir, create an account, and log in to access scientific resources.

Q: Is downloading articles from SID free?

Some articles on SID are available for free, while others require payment. Details are specified on the article's page.

Azad Aghaward Seta; Abbas Layla Jasim; Hussein Kawkab Ali

Educational Videos and Scientific Workshops

Scientific Information Database

ISSN: 2588-4824

Journal Paper

Paper Information

Journal: Journal of Medicinal and Chemical Sciences Year:2023 | Volume:6 | Issue:8 Page(s): 1714-1726

Download Full-Text

View:

Download:

Cites:

Information Journal Paper

Title

Synthesis, Characterisation, and Biological and Computational Studies of Novel Schiff Bases from Heterocyclic Molecules

Author(s)

Azad Aghaward Seta | Abbas Layla Jasim | Hussein Kawkab Ali | Issue Writer Certificate

Keywords

Green synthesisQ4

Triazole Schiff BaseQ4

AnticancerQ4

Molecular dockingQ4

Abstract

Four new Triazole Schiff Bases were synthesized through the green condensation and were structurally confirmed by mass spectroscopy, IR, 1H NMR, TGA, and DSC. The chief advantages of the reported technique were its working ease, very mild reaction conditions, short reaction time, and high yield. Quantum chemical calculations were applied to investigate the optimized geometry and electronic structure of the compounds, S1-S4. DFT/B3LYP/6-31+G (d), was performed to determine the chemical quantum descriptors (CQDs). An analysis of the CQDs showed that the S1 compound had a higher molecular stability. The findings of the computational research revealed that there was a close interaction between the theoretical and experimental data. The synthesized compounds were studied for their Anticancer activity against two cell lines, MCF-7 and HepG2. The results revealed that the S3 and S4 compounds had a remarkable activity, with IC50 of 64.64 μg/mL and 23.52 μg/mL, respectively, thus, making them crucial components for Anticancer medicines in future studies. Molecular docking tests were carried out on the S3 and S4 compounds with the receptors 5EKN and 3PP0. The results exposed that the compounds were effective in inhibiting the receptors with a good binding energy to confirm their Anticancer activity.

Cites

No record.

References

No record.

Cite

Related Journal Papers

No record.

Related Seminar Papers

No record.

Related Plans

No record.

Recommended Workshops

مرکز اطلاعات علمی Scientific Information Database (SID) - Trusted Source for Research and Academic Resources

Download

Move to top

وبگردی