2-Methyl-1,10b-dihydro-5H-pyrazolo[1,5-c][1,3]benzoxazin-5-one.

Acta Crystallogr Sect E Struct Rep Online

Faculty of Pharmacy, Comenius University, Odbojarov 10, SK-83232 Bratislava, Slovakia.

Published: April 2009

In the title compound, C(11)H(10)N(2)O(2), a potential inhibitor of the cyclo-oxygenase-2 isoenzyme, the pyrazoline ring exists in a flat-envelope conformation while the puckering of the central oxazine ring is more severe. As a result, the mol-ecule as a whole is non-planar. The formal sp(3) pyrazoline N atom is sp(2) hybridized, with the lone-pair electrons delocalized through conjugation with the carbonyl group rather than the double bond of the pyrazoline ring.

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http://www.ncbi.nlm.nih.gov/pmc/articles/PMC2977679PMC
http://dx.doi.org/10.1107/S1600536809012173DOI Listing

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