CAS 886500-60-3

2-[(7-Chloro-3,4-dihydro-3-methyl-4-oxo-2-quinazolinyl)thio]acetic acid

Description:

2-[(7-Chloro-3,4-dihydro-3-methyl-4-oxo-2-quinazolinyl)thio]acetic acid, with the CAS number 886500-60-3, is a chemical compound characterized by its unique structure that includes a quinazoline moiety and a thioacetic acid functional group. This compound typically exhibits properties such as moderate solubility in polar solvents, which is influenced by the presence of the carboxylic acid group. The chloro and methyl substituents on the quinazoline ring contribute to its biological activity, potentially enhancing its interaction with biological targets. The thioether linkage may impart specific reactivity and stability characteristics, making it of interest in medicinal chemistry. Additionally, compounds of this nature may exhibit pharmacological properties, including antimicrobial or anti-inflammatory effects, although specific biological activities would require empirical investigation. Overall, the compound's structural features suggest potential utility in drug development and research applications, particularly in the fields of medicinal and organic chemistry.

Formula: C₁₁H₉ClN₂O₃S

InChI: InChI=1S/C11H9ClN2O3S/c1-14-10(17)7-3-2-6(12)4-8(7)13-11(14)18-5-9(15)16/h2-4H,5H2,1H3,(H,15,16)

InChI key: InChIKey=ZILBUEJATAWVCD-UHFFFAOYSA-N

SMILES: O=C1C=2C(N=C(SCC(O)=O)N1C)=CC(Cl)=CC2

Synonyms:

• Acetic acid, [(7-chloro-3,4-dihydro-3-methyl-4-oxo-2-quinazolinyl)thio]-
• Acetic acid, 2-[(7-chloro-3,4-dihydro-3-methyl-4-oxo-2-quinazolinyl)thio]-
• 2-[(7-Chloro-3,4-dihydro-3-methyl-4-oxo-2-quinazolinyl)thio]acetic acid