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Substance Name: Benzoic acid, 2-(((6,8-dibromo-3,4-dihydro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl)methyl)thio)-
RN: 108635-34-3
InChIKey: NDJQQHAZZFDEBK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H16-Br2-N2-O4-S

Molecular Weight

  • 576.2634
 
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Names and Synonyms

  • Benzoic acid, 2-(((6,8-dibromo-3,4-dihydro-3-(2-methoxyphenyl)-4-oxo-2-quinazolinyl)methyl)thio)-

Registry Numbers

CAS Registry Number

  • 108635-34-3

System Generated Number

  • 0108635343

Structure Descriptors

InChI

1S/C23H16Br2N2O4S/c1-31-18-8-4-3-7-17(18)27-20(12-32-19-9-5-2-6-14(19)23(29)30)26-21-15(22(27)28)10-13(24)11-16(21)25/h2-11H,12H2,1H3,(H,29,30)

InChIKey

NDJQQHAZZFDEBK-UHFFFAOYSA-N

Smiles

COc1ccccc1n2c(nc3c(c2=O)cc(cc3Br)Br)CSc4ccccc4C(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD unreported > 1200mg/kg (1200mg/kg)   Indian Journal of Pharmaceutical Sciences. Vol. 48, Pg. 13, 1986.