Crystal Structure of Methyl 2-(3-oxo-3,4-dihydro-2H-1,4-benzothiazin-4-yl)acetate
Author Information
Author(s): Barryala Yamna, Massip Stéphane, Lazar Saïd, Essassi El Mokhtar, Zouihri Hafid
Primary Institution: Laboratoire de Chimie Organique et Etudes Physico-chimiques ENS Takaddoum, Rabat, Morocco
Hypothesis
The goal of the present work was the synthesis, the crystal structure determination and the biological test of the methyl (3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl)acetate.
Conclusion
The crystal structure of the compound shows that the molecules are linked by intermolecular hydrogen-bond interactions.
Supporting Evidence
- The heterocyclic thiazine ring adopts a conformation intermediate between twist and boat.
- The methyl acetate group is almost planar and inclined at specific angles with respect to the thiazine and benzene rings.
- The bond distances and angles in the title compound agree with those reported in related compounds.
Takeaway
Scientists studied a special chemical compound to see how its molecules fit together, and they found that they stick together in a certain way.
Methodology
The compound was synthesized and its crystal structure was determined using X-ray diffraction.
Digital Object Identifier (DOI)
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