Abstract

SYNTHESIS, MOLECULAR PROPERTIES PREDICTION AND BIOLOGICAL ACTIVITY OF BENZIMIDAZOLE TRITHIOCARBAMATE DERIVATIVES

A.N.V.Sunitha, S. Sharada, M.S.N.Sandhya, T.Saritha Jyostna*

Abstract

In the present investigation, a series of novel Benzimidazole trithiocarbamates have been synthesized. It deals with the design and calculation of Molecular Properties, Druglikeness, Lipophilicity and solubility parameters using Molinspiration, Molsoft softwares. Toxicity parameters were calculated using Osiris software. All the compounds are non-toxic, fulfill the solubility requirements and passing oral bioavailibility criteria. The compounds were synthesized and characterized by IR, 1H NMR and Mass Spectral analysis followed by antimicrobial screening. Most of the synthesized compounds (4a-4f) were found to be on conformity with Lipinski’s “Rule of Five” and other parameters, for their onward screening for antimicrobial activity as oral active drugs.

Keywords: Benzimidazole, Trithiocarbamate, Molinspiration, Molsoft, Osiris, Antimicrobial activities.