5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1H-chromeno[2,3-d]pyrim­idine-2,4(3H,5H)-dione 3.5-hydrate

The title compound, C(19)H(19)N(5)O(5)·3.5H(2)O, crystallizes with 3.5 mol­ecules of water in the asymmetric unit, one of which lies on a mirror plane. One of the water mol­ecules links the mol­ecules, forming centrosymmetric dimers. These dimers are then linked through further N—H⋯O and O—H⋯O hydro...

Descripción completa

Detalles Bibliográficos
Autores principales: Roy, Subhadip, Das, Subrata
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2013
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3685110/
https://www.ncbi.nlm.nih.gov/pubmed/23795129
http://dx.doi.org/10.1107/S1600536813013986
_version_ 1782273659952431104
author Roy, Subhadip
Das, Subrata
author_facet Roy, Subhadip
Das, Subrata
author_sort Roy, Subhadip
collection PubMed
description The title compound, C(19)H(19)N(5)O(5)·3.5H(2)O, crystallizes with 3.5 mol­ecules of water in the asymmetric unit, one of which lies on a mirror plane. One of the water mol­ecules links the mol­ecules, forming centrosymmetric dimers. These dimers are then linked through further N—H⋯O and O—H⋯O hydrogen bonding, leading to the observed three-dimensional structure.
format Online
Article
Text
id pubmed-3685110
institution National Center for Biotechnology Information
language English
publishDate 2013
publisher International Union of Crystallography
record_format MEDLINE/PubMed
spelling pubmed-36851102013-06-21 5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1H-chromeno[2,3-d]pyrim­idine-2,4(3H,5H)-dione 3.5-hydrate Roy, Subhadip Das, Subrata Acta Crystallogr Sect E Struct Rep Online Organic Papers The title compound, C(19)H(19)N(5)O(5)·3.5H(2)O, crystallizes with 3.5 mol­ecules of water in the asymmetric unit, one of which lies on a mirror plane. One of the water mol­ecules links the mol­ecules, forming centrosymmetric dimers. These dimers are then linked through further N—H⋯O and O—H⋯O hydrogen bonding, leading to the observed three-dimensional structure. International Union of Crystallography 2013-05-25 /pmc/articles/PMC3685110/ /pubmed/23795129 http://dx.doi.org/10.1107/S1600536813013986 Text en © Roy and Das 2013 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
Roy, Subhadip
Das, Subrata
5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1H-chromeno[2,3-d]pyrim­idine-2,4(3H,5H)-dione 3.5-hydrate
title 5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1H-chromeno[2,3-d]pyrim­idine-2,4(3H,5H)-dione 3.5-hydrate
title_full 5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1H-chromeno[2,3-d]pyrim­idine-2,4(3H,5H)-dione 3.5-hydrate
title_fullStr 5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1H-chromeno[2,3-d]pyrim­idine-2,4(3H,5H)-dione 3.5-hydrate
title_full_unstemmed 5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1H-chromeno[2,3-d]pyrim­idine-2,4(3H,5H)-dione 3.5-hydrate
title_short 5-(6-Amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1H-chromeno[2,3-d]pyrim­idine-2,4(3H,5H)-dione 3.5-hydrate
title_sort 5-(6-amino-1,3-dimethyl-2,4-dioxo-1,2,3,4-tetra­hydropyrimidin-5-yl)-1,3-dimethyl-1h-chromeno[2,3-d]pyrim­idine-2,4(3h,5h)-dione 3.5-hydrate
topic Organic Papers
url https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3685110/
https://www.ncbi.nlm.nih.gov/pubmed/23795129
http://dx.doi.org/10.1107/S1600536813013986
work_keys_str_mv AT roysubhadip 56amino13dimethyl24dioxo1234tetrahydropyrimidin5yl13dimethyl1hchromeno23dpyrimidine243h5hdione35hydrate
AT dassubrata 56amino13dimethyl24dioxo1234tetrahydropyrimidin5yl13dimethyl1hchromeno23dpyrimidine243h5hdione35hydrate

Ejemplares similares