Mn(II) catalyzed synthesis of 5(4-hydroxyphenyl)-2-(N-phenylamino)-1,3,4-oxadiazole: Crystal structure, DFT, molecular docking, Hirshfeld surface analysis, and in vitro anticancer activity on DL cells
M.K. Gond, Alok Shukla, Shivendra Kumar Pandey, M.K. Bharty, Biswajit Maiti, Arbind Acharya, Neeraj Tiwari, Diksha Katiyar, Ray J. Butcher
Topics & Concepts
ChemistryOrthorhombic crystal systemDocking (animal)Crystal structureOxadiazoleHydrogen bondMoleculeStereochemistryCytotoxicityHOMO/LUMOIn vitroCrystallographyOrganic chemistryBiochemistryMedicineNursingSynthesis and biological activitySynthesis and Biological EvaluationQuinazolinone synthesis and applications