Molecular docking studies and facile synthesis of most potent biologically active N-tert-butyl-4-(4-substituted phenyl)-2-((substituted-2-oxo-2H-chromen-4-yl)methylthio)-6-oxo-1,6-dihydropyrimidine-5-carboxamide hybrids: An approach for microwave-assisted syntheses and biological evaluation

2018 ◽  
Vol 78 ◽  
pp. 185-194 ◽  
Author(s):  
Rakesh R. Chavan ◽  
Kallappa M. Hosamani ◽  
Badarinath D. Kulkarni ◽  
Shrinivas D. Joshi
Keyword(s):  
Molecular Docking ◽  
Docking Studies ◽  
Biological Evaluation ◽  
Biologically Active ◽  
Facile Synthesis ◽  
Molecular Docking Studies ◽  
Tert Butyl ◽  
Microwave Assisted

scholarly journals Microwave-Assisted Synthesis, Molecular Docking Studies and Biological Evaluation of Benzothiazole Containing Novel Indole Derivatives

2021 ◽  
Vol 33 (11) ◽  
pp. 2755-2761
Author(s):  
Shaheen Sultana ◽  
P. Pandian ◽  
B. Rajkamal
Keyword(s):  
Molecular Docking ◽  
Reaction Mechanism ◽  
Anticancer Activity ◽  
Mannich Base ◽  
Docking Studies ◽  
Biological Evaluation ◽  
Indole Derivatives ◽  
Standard Drug ◽  
Molecular Docking Studies ◽  
Microwave Assisted

The synthesis of novel indole derivatives 4a-o using a microwave assisted method via Schiff’s base and Mannich base reaction mechanism was described. Compounds 3a-c were synthesized via reaction of 2-amino benzothiazole with substituted isatin by Schiff base reaction mechanism. Also, indole derivatives 4a-o were synthesized via reaction of compounds 3a-c with substituted benzaldehydes by Mannich base reaction. The biological potentials of the newly synthesized indole derivatives were evaluated for their anthelmintic activity and in vitro anticancer activity by MTT assay. The anticancer activity results suggested that indole derivatives 4c-o have activity against MCF-7 and SKOV3 cells in comparison with doxorubicin as standard drug. Furthermore, the molecular docking studies of these novel derivatives of indole showed good agreement with the biological results when their binding pattern and affinity towards the active site of EGFR was also investigated.

scholarly journals Facile synthesis, biological evaluation and molecular docking studies of novel substituted azole derivatives

2017 ◽  
Vol 1138 ◽  
pp. 177-191 ◽  
Author(s):  
Muhammad Rafiq ◽  
Muhammad Saleem ◽  
Farukh Jabeen ◽  
Muhammad Hanif ◽  
Sung-Yum Seo ◽  
...  
Keyword(s):  
Molecular Docking ◽  
Docking Studies ◽  
Biological Evaluation ◽  
Facile Synthesis ◽  
Molecular Docking Studies

scholarly journals Microwave-assisted synthesis, biological evaluation and molecular docking studies of new coumarin-based 1,2,3-triazoles

RSC Advances ◽  
2020 ◽  
Vol 10 (20) ◽  
pp. 11615-11623 ◽  
Author(s):  
Ravinder Dharavath ◽  
Nalaparaju Nagaraju ◽  
M. Ram Reddy ◽  
D. Ashok ◽  
M. Sarasija ◽  
...  
Keyword(s):  
Molecular Docking ◽  
Click Reaction ◽  
Docking Studies ◽  
Biological Evaluation ◽  
Microwave Assisted Synthesis ◽  
Terminal Alkynes ◽  
Triazole Derivatives ◽  
Molecular Docking Studies ◽  
Microwave Assisted ◽  
Highly Efficient

Coumarin-based 1,4-disubstituted 1,2,3-triazole derivatives were synthesized using a highly efficient, eco-friendly protocol via a copper(i)-catalyzed click reaction between various substituted arylazides and terminal alkynes.

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