Ethyl 1-sec-butyl-2-phenyl-1H-benzimidazole-5-carboxyl-ate
- PMID: 21580635
- PMCID: PMC2984087
- DOI: 10.1107/S160053681000872X
Ethyl 1-sec-butyl-2-phenyl-1H-benzimidazole-5-carboxyl-ate
Abstract
In the title mol-ecule, C(20)H(22)N(2)O(2), the benzimidazole ring system is essentially planar, with a maximum deviation of 0.024 (1) Å. The dihedral angle between the phenyl and benzimidazole ring system is 43.71 (5)°. The atoms of the butyl group are disordered over two sets of sites with occupancies of 0.900 (4) and 0.100 (4). In the crystal structure, mol-ecules are connected by weak inter-molecular C-H⋯O hydrogen bonds, forming chains along the b axis. The crystal structure is further stabilized by C-H⋯π inter-actions.
Figures


References
-
- Bruker (2009). APEX2, SAINT and SADABS Bruker AXS Inc., Madison, Wisconsin, USA.
-
- Cosier, J. & Glazer, A. M. (1986). J. Appl. Cryst.19, 105–107.
-
- Demirayak, S., Abu Mohsen, U. & Caqri Karaburun, A. (2002). Eur. J. Med. Chem.37, 255–260. - PubMed
-
- Evans, T. M., Gardiner, J. M., Mahmood, N. & Smis, M. (1997). Bioorg. Med. Chem. Lett.7, 409–412.
-
- Grassmann, S., Sadek, B., Ligneau, X., Elz, S., Ganellin, C. R., Arrang, J. M., Schwartz, J. C., Stark, H. & Schunack, W. (2002). Eur. J. Pharm. Sci.15, 367–378. - PubMed
LinkOut - more resources
Full Text Sources
Research Materials