Burnett, Marianne E. published the artcileStructural characterization of the aquaporin inhibitor 2-nicotinamido-1,3,4-thiadiazole, Synthetic Route of 51987-99-6, the publication is Acta Crystallographica, Section C: Structural Chemistry (2015), 71(12), 1074-1079, database is CAplus and MEDLINE.
Nicotinamides are a class of compounds with a wide variety of applications, from use as antimicrobial agents to inhibitors of biol. processes. These compounds are also cofactors, which are necessary components of metabolic processes. Structural modification gives rise to the activities observed Similarly, 1,3,4-thiadiazoles have been shown to possess antioxidant, antimicrobial, or anti-inflammatory biol. activity. To take advantage of each of the inherent characteristics of the two aforementioned functional groups, 2-nicotinamido-1,3,4-thiadiazole, C8H6N4OS, was synthesized. Since defining chem. connectivity is paramount in understanding biol. activity, in this report, the structural characterization of 2-nicotinamido-1,3,4-thiadiazole has been carried out using X-ray crystallog. methods. The NMR-derived assignments were made possible by utilizing one- (1D) and two-dimensional (2D) NMR techniques. In addition, UV-Visible and IR spectroscopies, and elemental anal. were used to fully characterize the product synthesized by the one-step reaction between nicotinoyl chloride hydrochloride and 2-amino-1,3,4-thiadiazole. Computational parameters related to blood-brain barrier permeability are also presented.
Acta Crystallographica, Section C: Structural Chemistry published new progress about 51987-99-6. 51987-99-6 belongs to amides-buliding-blocks, auxiliary class Pyridine,Thiadiazole,Amine,Amide,Inhibitor, name is N-(1,3,4-Thiadiazol-2-yl)nicotinamide, and the molecular formula is C8H6N4OS, Synthetic Route of 51987-99-6.
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