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We report the synthesis and theoretical investigations of three novelpseudo-peptide molecules derived from 2-amino-2-(1H-indole-2-yl) acetamides.The compounds were subjected to spectroscopic characterization ($^1$H,$^{13}$C-NMR and MS) and their chemical, electronic, and optical propertieshave been investigated. To ascertain their potential pharmacologicalapplicability, the prospective reactive centers and molecular sites prone tointeraction with water were identified along with possible sensitivity toautoxidation. Further, we have studied the optical response in the presence ofdifferent solvents and compared the electronic and optical properties of thepristine molecules. We highlight the subtle dependence of the properties on thestructure and composition of these pseudo-peptides. Our results indicate thatthese molecules have high pharmaceutical potential and could serve as leadcomponents in new drug formulations.

Indole moiety induced biological potency in pseudo- peptides derived  from 2-amino-2-(1H-indole-2-yl) based acetamides: synthesis, structure and  computational investigations