Methyl 4-[N-(5-bromo­pyrimidin-2-yl)carbamo­yl]benzoate

In the title compound, C(13)H(10)BrN(3)O(3), the pyrimidine and benzene rings are twisted with an inter­planar angle of 58.4 (1)°. The secondary amide group adopts a cis conformation with an H—N—C—O torsion angle of 14.8 (1)°. In the crystal, mol­ecules are connected into inversion dimers via pairs...

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Detalles Bibliográficos
Autores principales: Hu, Hui-Ling, Wu, Chia-Jun, Yeh, Chun-Wei, Chen, Jhy-Der
Formato: Online Artículo Texto
Lenguaje:English
Publicado: International Union of Crystallography 2012
Materias:
Organic Papers
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC3414950/
https://www.ncbi.nlm.nih.gov/pubmed/22904937
http://dx.doi.org/10.1107/S1600536812032102
Descripción
Sumario:In the title compound, C(13)H(10)BrN(3)O(3), the pyrimidine and benzene rings are twisted with an inter­planar angle of 58.4 (1)°. The secondary amide group adopts a cis conformation with an H—N—C—O torsion angle of 14.8 (1)°. In the crystal, mol­ecules are connected into inversion dimers via pairs of N—H⋯N hydrogen bonds, generating an R (2) (2)(8) motif. The dimers are further connected through a C—Br⋯O inter­action [3.136 (1) Å and 169.31 (1)°] into a chain along [110]. Weak C—H⋯N hydrogen bonds between the methyl benzoate groups and pyrimidine rings are also observed in the crystal structure.

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