dc.creatorMacedo, OFL
dc.creatorAndrade, GRS
dc.creatorConegero, LS
dc.creatorBarreto, LS
dc.creatorCosta, NB
dc.creatorGimenez, IF
dc.creatorAlmeida, LE
dc.creatorKubota, D
dc.date2012
dc.dateFEB
dc.date2014-07-30T14:32:06Z
dc.date2015-11-26T18:06:10Z
dc.date2014-07-30T14:32:06Z
dc.date2015-11-26T18:06:10Z
dc.date.accessioned2018-03-29T00:48:22Z
dc.date.available2018-03-29T00:48:22Z
dc.identifierSpectrochimica Acta Part A-molecular And Biomolecular Spectroscopy. Pergamon-elsevier Science Ltd, v. 86, n. 101, n. 106, 2012.
dc.identifier1386-1425
dc.identifierWOS:000300515500017
dc.identifier10.1016/j.saa.2011.10.010
dc.identifierhttp://www.repositorio.unicamp.br/jspui/handle/REPOSIP/59807
dc.identifierhttp://repositorio.unicamp.br/jspui/handle/REPOSIP/59807
dc.identifier.urihttp://repositorioslatinoamericanos.uchile.cl/handle/2250/1293294
dc.descriptionConselho Nacional de Desenvolvimento Científico e Tecnológico (CNPq)
dc.descriptionCoordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)
dc.descriptionHere we report the preparation of a trimethoprim/2-hydroxypropyl-gamma-cyclodextrin inclusion complex along with a physicochemical study, structural characterization, and molecular modeling of the complex. As main results, we observed from phase-solubility studies at two temperatures (20 degrees C and 35 degrees C) that the association constants decrease with increasing temperature. Values for K-1:1 constant were of the same magnitude order of those found for the parent gamma-CD. The inclusion orientation as evidenced by ROESY measurements involves the inclusion of the 3.45-trimethoxybenzyl ring in the CD cavity from the larger rim. This is in agreement with semiempirical molecular modeling calculation. (C) 2011 Elsevier B.V. All rights reserved.
dc.description86
dc.description101
dc.description106
dc.descriptionFinep
dc.descriptionConselho Nacional de Desenvolvimento Científico e Tecnológico (CNPq)
dc.descriptionCoordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)
dc.descriptionFapitec
dc.descriptionConselho Nacional de Desenvolvimento Científico e Tecnológico (CNPq)
dc.descriptionCoordenação de Aperfeiçoamento de Pessoal de Nível Superior (CAPES)
dc.languageen
dc.publisherPergamon-elsevier Science Ltd
dc.publisherOxford
dc.publisherInglaterra
dc.relationSpectrochimica Acta Part A-molecular And Biomolecular Spectroscopy
dc.relationSpectroc. Acta Pt. A-Molec. Biomolec. Spectr.
dc.rightsfechado
dc.rightshttp://www.elsevier.com/about/open-access/open-access-policies/article-posting-policy
dc.sourceWeb of Science
dc.subjectTrimethoprim
dc.subject2-Hydroxypropyl-gamma-cyclodextrin
dc.subjectInclusion complex
dc.subjectPhase-solubility diagram
dc.subjectMolecular modeling
dc.subjectBeta-cyclodextrin
dc.subjectSemiempirical Methods
dc.subjectTrimethoprim
dc.subjectOptimization
dc.subjectParameters
dc.subjectChemistry
dc.subjectStability
dc.subjectAm1
dc.titlePhysicochemical study and characterization of the trimethoprim/2-hydroxypropyl-gamma-cyclodextrin inclusion complex
dc.typeArtículos de revistas


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