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CAS 16499-59-5

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8-(Trifluoromethyl)-4(3H)-quinazolinone

Description:
8-(Trifluoromethyl)-4(3H)-quinazolinone is a heterocyclic organic compound characterized by the presence of a quinazolinone core, which is a bicyclic structure containing both a benzene and a pyrimidine ring. The trifluoromethyl group (-CF3) attached to the 8-position significantly influences the compound's chemical properties, enhancing its lipophilicity and potentially its biological activity. This compound is typically a solid at room temperature and may exhibit moderate solubility in organic solvents. Its structure suggests potential applications in medicinal chemistry, particularly in the development of pharmaceuticals, due to the presence of the quinazolinone moiety, which is known for various biological activities, including anti-inflammatory and anticancer properties. The trifluoromethyl group can also enhance metabolic stability and bioavailability. As with many fluorinated compounds, it may exhibit unique reactivity patterns, making it of interest in synthetic organic chemistry. Safety data should be consulted for handling, as fluorinated compounds can pose specific health and environmental risks.
Formula:C9H5F3N2O
InChI:InChI=1S/C9H5F3N2O/c10-9(11,12)6-3-1-2-5-7(6)13-4-14-8(5)15/h1-4H,(H,13,14,15)
InChI key:InChIKey=YVUGNQDFJMZZGV-UHFFFAOYSA-N
SMILES:C(F)(F)(F)C1=C2C(C(=O)N=CN2)=CC=C1
Synonyms:
  • 4(3H)-Quinazolinone, 8-(trifluoromethyl)-
  • 8-(Trifluoromethyl)quinazolin-4-ol
  • 4(1H)-Quinazolinone, 8-(trifluoromethyl)-
  • 8-(Trifluoromethyl)-4(3H)-quinazolinone
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