✨
AI Summary & Key Takeaways
AI Insight⚡ TL;DR(Too Long; Didn't Read)
The result of descriptors calculation revealed that the theoretical approach was in good agreement with the reported experimental data.
📌 3 Key Takeaways
🎯
Objective & Hypothesis:A new series of 5-Chloroisatin derivatives were synthesied and characterises with different characterization methods such as 1H-NMR and13C-NMR spectroscopy, and then tested for their myorelaxant activity.
📊
Key Findings & Data:Computational investigations of the compounds 1a-3a, 2b and 4b on the muscle-relaxing effects performance were performed by using the DFT method with B3LYP functional.
💡
Conclusion & Impact:The result of descriptors calculation revealed that the theoretical approach was in good agreement with the reported experimental data.
🔬Design:Research Article
📍Scope:Comprehensive Sample
⚙️Variables:5-Chloroisatin derivatives · B3LYP functional and DFT method · synthesis
Abstract
A new series of 5-Chloroisatin derivatives were synthesied and characterises with different characterization methods such as 1H-NMR and13C-NMR spectroscopy, and then tested for their myorelaxant activity. Computational investigations of the compounds 1a-3a, 2b and 4b on the muscle-relaxing effects performance were performed by using the DFT method with B3LYP functional. The result of descriptors calculation revealed that the theoretical approach was in good agreement with the reported experimental data.
🔖
Cite This Article
TRİBAK, Z., CHDA, A., SKALLİ, M. K., HAOUDİ, A., RODİ, Y. K., SENHAJİ, O., ESSASSİ, E. M., CHEİKH, R. B., ABİDA, K. E. (2018). Theoretical approach using DFT and muscle relaxant effects of 5-Chloroisatin Derivatives. International Journal of Chemistry and Technology, Cilt: 2 - Sayı: 2, 105–115. https://ajindex.com/articles/765704