Partial inclusion of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin: Spectroscopic characterization, in vitro and in silico antimicrobial evaluation
Abstract Silver complexes containing 1,10-phenanthroline as a coordinated ligand have been of great interest due to their antibacterial and antifungal pharmacological properties. In this paper, we describe the synthesis of a new partial inclusion complex of bis(1,10-phenanthroline)silver(I) salicyla...
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Academia Brasileira de Ciências
2020-11-01
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| Series: | Anais da Academia Brasileira de Ciências |
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| Online Access: | http://www.scielo.br/scielo.php?script=sci_arttext&pid=S0001-37652020000500509&tlng=en |
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| author | EDWIN BRIÑEZ-ORTEGA VERA L. DE ALMEIDA JULIO C.D. LOPES ANA E. BURGOS |
| author_facet | EDWIN BRIÑEZ-ORTEGA VERA L. DE ALMEIDA JULIO C.D. LOPES ANA E. BURGOS |
| author_sort | EDWIN BRIÑEZ-ORTEGA |
| collection | DOAJ |
| description | Abstract Silver complexes containing 1,10-phenanthroline as a coordinated ligand have been of great interest due to their antibacterial and antifungal pharmacological properties. In this paper, we describe the synthesis of a new partial inclusion complex of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin (β-CD) which was synthesized with a good yield. The compounds were characterized by FTIR, 1H, 13C NMR including 1H−1H COSY, TGA/DSC, elemental analysis (CHN), and X-ray powder diffraction. The results suggest the presence of non-covalent interactions such as hydrogen bonds, van der Waals forces, and hydrophobic interactions in the formation of the partial inclusion compound between β-CD and bis(1,10-phenanthroline)silver(I) salicylate [Ag(phen)2]salH. Additionally, an in silico prediction of 1,10-phenanthroline biological activities was carried out and the acquired data suggests several potential targets associated with the antimicrobial activity of this compound and its silver complex. Most predicted targets are related to antimicrobial virulence and resistance that are a serious threat to global public health. The inclusion compound showed a higher inhibiting growth of Candida albicans than the free complex [Ag(phen)2]salH indicating that the formation of the inclusion complex with β-CD increases the bioavailability of the antimicrobial active species [Ag(phen)2]+ of the new silver(I) compound. |
| first_indexed | 2024-12-17T20:13:12Z |
| format | Article |
| id | doaj.art-56d20d6835ec41a8b9b10338120e32b2 |
| institution | Directory Open Access Journal |
| issn | 1678-2690 |
| language | English |
| last_indexed | 2024-12-17T20:13:12Z |
| publishDate | 2020-11-01 |
| publisher | Academia Brasileira de Ciências |
| record_format | Article |
| series | Anais da Academia Brasileira de Ciências |
| spelling | doaj.art-56d20d6835ec41a8b9b10338120e32b22022-12-21T21:34:11ZengAcademia Brasileira de CiênciasAnais da Academia Brasileira de Ciências1678-26902020-11-0192310.1590/0001-3765202020181323Partial inclusion of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin: Spectroscopic characterization, in vitro and in silico antimicrobial evaluationEDWIN BRIÑEZ-ORTEGAhttps://orcid.org/0000-0002-6260-1018VERA L. DE ALMEIDAhttps://orcid.org/0000-0002-4981-2216JULIO C.D. LOPEShttps://orcid.org/0000-0002-5872-7611ANA E. BURGOShttps://orcid.org/0000-0001-6117-5312Abstract Silver complexes containing 1,10-phenanthroline as a coordinated ligand have been of great interest due to their antibacterial and antifungal pharmacological properties. In this paper, we describe the synthesis of a new partial inclusion complex of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin (β-CD) which was synthesized with a good yield. The compounds were characterized by FTIR, 1H, 13C NMR including 1H−1H COSY, TGA/DSC, elemental analysis (CHN), and X-ray powder diffraction. The results suggest the presence of non-covalent interactions such as hydrogen bonds, van der Waals forces, and hydrophobic interactions in the formation of the partial inclusion compound between β-CD and bis(1,10-phenanthroline)silver(I) salicylate [Ag(phen)2]salH. Additionally, an in silico prediction of 1,10-phenanthroline biological activities was carried out and the acquired data suggests several potential targets associated with the antimicrobial activity of this compound and its silver complex. Most predicted targets are related to antimicrobial virulence and resistance that are a serious threat to global public health. The inclusion compound showed a higher inhibiting growth of Candida albicans than the free complex [Ag(phen)2]salH indicating that the formation of the inclusion complex with β-CD increases the bioavailability of the antimicrobial active species [Ag(phen)2]+ of the new silver(I) compound.http://www.scielo.br/scielo.php?script=sci_arttext&pid=S0001-37652020000500509&tlng=enBis(110-phenanthroline)silver(I)β-cyclodextrinin silico predictionSVM modelingantimicrobial |
| spellingShingle | EDWIN BRIÑEZ-ORTEGA VERA L. DE ALMEIDA JULIO C.D. LOPES ANA E. BURGOS Partial inclusion of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin: Spectroscopic characterization, in vitro and in silico antimicrobial evaluation Anais da Academia Brasileira de Ciências Bis(1 10-phenanthroline)silver(I) β-cyclodextrin in silico prediction SVM modeling antimicrobial |
| title | Partial inclusion of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin: Spectroscopic characterization, in vitro and in silico antimicrobial evaluation |
| title_full | Partial inclusion of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin: Spectroscopic characterization, in vitro and in silico antimicrobial evaluation |
| title_fullStr | Partial inclusion of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin: Spectroscopic characterization, in vitro and in silico antimicrobial evaluation |
| title_full_unstemmed | Partial inclusion of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin: Spectroscopic characterization, in vitro and in silico antimicrobial evaluation |
| title_short | Partial inclusion of bis(1,10-phenanthroline)silver(I) salicylate in β-cyclodextrin: Spectroscopic characterization, in vitro and in silico antimicrobial evaluation |
| title_sort | partial inclusion of bis 1 10 phenanthroline silver i salicylate in β cyclodextrin spectroscopic characterization in vitro and in silico antimicrobial evaluation |
| topic | Bis(1 10-phenanthroline)silver(I) β-cyclodextrin in silico prediction SVM modeling antimicrobial |
| url | http://www.scielo.br/scielo.php?script=sci_arttext&pid=S0001-37652020000500509&tlng=en |
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