Abstract

DESIGN, SYNTHESIS AND DOCKING STUDIES OF 2, 5- DISUBSTITUTED-1, 3, 4-OXADIAZOLE INVOLVED IN BREAST CANCER

Shaik Fahmida Neelofar., Venkata Swamy Tangeti., D.Jayasimha Rayalu*.,D.Muralidhara rao., D.S.Rao

ABSTRACT

Cancer has proven to be one of the most intractable diseases to which humans are subjected, and as yet no practical and general effective drugs or methods of control. Therefore, identification of novel potent, selective, and less toxic anticancer agents remains one of the most pressing health problems. In the present research a series of 50 oxadiazole derivatives were designed and evaluated docking studies were performed using Open eye software against cancer protein of Breast cancer [ B-cell lymphoma 2-BCL2 (1G5M) ]. The docking results showed that highest value (-201.59K.cal/mol) for the compound 22 in Breast Cancer. The top six compounds which showed highest docking scores were synthesized. The compounds were isolated with TLC, purified with column chromatography and evaluated by spectroscopic method.

Keywords: Breast Cancer, BCL-2, Oxadiazole, Docking, Synthesis.