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CAS 1512-75-0

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3-(3-FLUORO-4-METHYLPHENYL)-2-MERCAPTOQUINAZOLIN-4(3H)-ONE

Description:
3-(3-Fluoro-4-methylphenyl)-2-mercaptoquinazolin-4(3H)-one is a chemical compound characterized by its quinazolinone core structure, which is a bicyclic compound containing a benzene ring fused to a pyrimidine ring. The presence of a mercapto (-SH) group contributes to its potential reactivity, particularly in nucleophilic substitution reactions. The fluorine atom in the para position of the methyl-substituted phenyl ring can influence the compound's electronic properties and lipophilicity, potentially affecting its biological activity. This compound may exhibit various pharmacological properties, making it of interest in medicinal chemistry. Its molecular structure suggests potential applications in drug development, particularly in targeting specific biological pathways. The CAS number 1512-75-0 uniquely identifies this substance in chemical databases, facilitating research and regulatory processes. Overall, the characteristics of this compound highlight its significance in both synthetic and applied chemistry contexts.
Formula:C15H11FN2OS
InChI:InChI=1/C15H11FN2OS/c1-9-6-7-10(8-12(9)16)18-14(19)11-4-2-3-5-13(11)17-15(18)20/h2-8H,1H3,(H,17,20)
SMILES:Cc1ccc(cc1F)n1c(=O)c2ccccc2nc1S
Synonyms:
  • 3-(3-fluoro-4-methylphenyl)-2-thioxo-2,3-dihydroquinazolin-4(1H)-one
  • 3-(3-fluoro-4-methylphenyl)-2-mercaptoquinazolin-4(3H)-one
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