Evaluación in silico y síntesis asistida por microondas de compuestos heterocíclicos con núcleo pirazolopiridínico como potenciales moduladores alostéricos de receptores GABA-A

dc.contributorCuervo Prado, Paola Andrea
dc.contributorGrupo de Estudios en Síntesis y Aplicaciones de Compuestos Heterocíclicos (Gesach)
dc.creatorLozano Oviedo, John Jair
dc.date.accessioned2022-08-31T20:56:47Z
dc.date.available2022-08-31T20:56:47Z
dc.date.created2022-08-31T20:56:47Z
dc.date.issued2022-08-28
dc.identifierhttps://repositorio.unal.edu.co/handle/unal/82230
dc.identifierUniversidad Nacional de Colombia
dc.identifierRepositorio Institucional Universidad Nacional de Colombia
dc.identifierhttps://repositorio.unal.edu.co/
dc.description.abstractEl presente estudio pretende aportar nuevas metodologías para la síntesis de núcleos pirazolopiridínicos, tetrahidropirazoloquinolinicos y tetrahidropirazoloisoquinolinicos, por medio de estrategias multicomponentes que involucran 5-aminopirazoles, cetonas cíclicas y olefinas ricas en electrones, empleando calentamiento convencional e inducido por microondas, en donde la exploración sintética condujo a una metodología novedosa que permite la obtención regioselectiva de las estructuras isómericas estudiadas. Por otra parte, esta investigación busca aportar moléculas bioactivas que puedan emplearse para el tratamiento de algunos trastornos del sistema nervioso central que involucran al receptor GABA-A, por lo tanto, se realizó una evaluación in silico de los prototipos propuestos que incluye una indagación de las propiedades farmacocinéticas, farmacodinámicas y afinidad por el receptor, exhibiendo un comportamiento promisorio como potenciales moduladores alostéricos del receptor GABA-A.
dc.description.abstractThe present study aims to provide new methodologies for the synthesis of pyrazolopyridine, tetrahydropyrazoloquinoline and tetrahydropyrazoloisoquinoline nuclei, through multicomponent strategies involving 5-aminopyrazoles, cyclic ketones and electron-rich olefins, using conventional and microwave-induced heating, where synthetic exploration led to a novel methodology that allows regioselective obtaining of the isomeric structures studied. On the other hand, this research seeks to provide bioactive molecules that can be used for the treatment of some disorders of the central nervous system that involve the GABA-A receptor, therefore, an in silico evaluation of the proposed prototypes was carried out, which includes an investigation of pharmacokinetic and pharmacodynamic properties and affinity for the receptor, exhibiting promising behavior as potential allosteric modulators of the GABA-A receptor
dc.languagespa
dc.publisherUniversidad Nacional de Colombia
dc.publisherBogotá - Ciencias - Maestría en Ciencias - Química
dc.publisherDepartamento de Química
dc.publisherFacultad de Ciencias
dc.publisherBogotá, Colombia
dc.publisherUniversidad Nacional de Colombia - Sede Bogotá
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dc.rightsReconocimiento 4.0 Internacional
dc.rightshttp://creativecommons.org/licenses/by/4.0/
dc.rightsinfo:eu-repo/semantics/openAccess
dc.rightsDerechos reservados al autor, 2022
dc.titleEvaluación in silico y síntesis asistida por microondas de compuestos heterocíclicos con núcleo pirazolopiridínico como potenciales moduladores alostéricos de receptores GABA-A
dc.typeTrabajo de grado - Maestría


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