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Marbofloxacin

In the title compound, [systematic name: 9-fluoro-2,3-dihydro-3-methyl-10-(4-methyl­piperazin-1-yl)-7-oxo-7H-pyrido[1,2,3-ij][1,2,4]benzoxadiazine-6-carb­oxy­lic acid], C(17)H(19)FN(4)O(4), the carbonyl and carboxyl groups are coplanar with the quinoline ring, making a dihedral angle of 2.39 (2)°. T...

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Detalles Bibliográficos
Autores principales: Shen, Jin, Qian, Jing-Jing, Gu, Jian-Ming, Hu, Xiu-Rong
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3343966/
https://www.ncbi.nlm.nih.gov/pubmed/22590047
http://dx.doi.org/10.1107/S1600536812009312
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author Shen, Jin
Qian, Jing-Jing
Gu, Jian-Ming
Hu, Xiu-Rong
author_facet Shen, Jin
Qian, Jing-Jing
Gu, Jian-Ming
Hu, Xiu-Rong
author_sort Shen, Jin
collection PubMed
description In the title compound, [systematic name: 9-fluoro-2,3-dihydro-3-methyl-10-(4-methyl­piperazin-1-yl)-7-oxo-7H-pyrido[1,2,3-ij][1,2,4]benzoxadiazine-6-carb­oxy­lic acid], C(17)H(19)FN(4)O(4), the carbonyl and carboxyl groups are coplanar with the quinoline ring, making a dihedral angle of 2.39 (2)°. The piperazine ring adopts a chair conformation and the oxadiazinane ring displays an envelope conformation with the CH(2) group at the flap displaced by 0.650 (2) Å from the plane through the other five atoms. The mol­ecular structure exhibits an S(6) ring motif, owing to an intra­molecular O—H⋯O hydrogen bond. In the crystal, weak C—H⋯F hydrogen bonds link mol­ecules into layers parallel to the ab plane.
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spelling pubmed-33439662012-05-15 Marbofloxacin Shen, Jin Qian, Jing-Jing Gu, Jian-Ming Hu, Xiu-Rong Acta Crystallogr Sect E Struct Rep Online Organic Papers In the title compound, [systematic name: 9-fluoro-2,3-dihydro-3-methyl-10-(4-methyl­piperazin-1-yl)-7-oxo-7H-pyrido[1,2,3-ij][1,2,4]benzoxadiazine-6-carb­oxy­lic acid], C(17)H(19)FN(4)O(4), the carbonyl and carboxyl groups are coplanar with the quinoline ring, making a dihedral angle of 2.39 (2)°. The piperazine ring adopts a chair conformation and the oxadiazinane ring displays an envelope conformation with the CH(2) group at the flap displaced by 0.650 (2) Å from the plane through the other five atoms. The mol­ecular structure exhibits an S(6) ring motif, owing to an intra­molecular O—H⋯O hydrogen bond. In the crystal, weak C—H⋯F hydrogen bonds link mol­ecules into layers parallel to the ab plane. International Union of Crystallography 2012-03-10 /pmc/articles/PMC3343966/ /pubmed/22590047 http://dx.doi.org/10.1107/S1600536812009312 Text en © Shen et al. 2012 http://creativecommons.org/licenses/by/2.0/uk/ This is an open-access article distributed under the terms of the Creative Commons Attribution Licence, which permits unrestricted use, distribution, and reproduction in any medium, provided the original authors and source are cited.
spellingShingle Organic Papers
Shen, Jin
Qian, Jing-Jing
Gu, Jian-Ming
Hu, Xiu-Rong
Marbofloxacin
title Marbofloxacin
title_full Marbofloxacin
title_fullStr Marbofloxacin
title_full_unstemmed Marbofloxacin
title_short Marbofloxacin
title_sort marbofloxacin
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3343966/
https://www.ncbi.nlm.nih.gov/pubmed/22590047
http://dx.doi.org/10.1107/S1600536812009312
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