CAS 959236-90-9
:8-(Trifluoromethyl)-2,4(1H,3H)-quinazolinedione
Description:
8-(Trifluoromethyl)-2,4(1H,3H)-quinazolinedione, identified by its CAS number 959236-90-9, is a synthetic organic compound characterized by its quinazoline core structure, which is a bicyclic compound containing a benzene ring fused to a pyrimidine ring. The presence of a trifluoromethyl group (-CF3) at the 8-position significantly influences its chemical properties, enhancing lipophilicity and potentially affecting its biological activity. This compound typically exhibits a solid state at room temperature and is soluble in organic solvents. Its structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the quinazoline moiety's known biological activities, including anticancer and antimicrobial properties. The trifluoromethyl group can also enhance metabolic stability and alter the compound's interaction with biological targets. As with many fluorinated compounds, it may exhibit unique reactivity patterns and environmental persistence, warranting careful handling and consideration in research and application contexts.
Formula:C9H5F3N2O2
InChI:InChI=1S/C9H5F3N2O2/c10-9(11,12)5-3-1-2-4-6(5)13-8(16)14-7(4)15/h1-3H,(H2,13,14,15,16)
InChI key:InChIKey=XVFUBOPZSVIZTK-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=C2C(C(=O)NC(=O)N2)=CC=C1
Synonyms:- 2,4(1H,3H)-Quinazolinedione, 8-(trifluoromethyl)-
- 8-(Trifluoromethyl)-2,4(1H,3H)-quinazolinedione
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