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Substance Name: 3(4H)-Quinazolineacetic acid, 6,8-dichloro-4-oxo-2-(alpha,alpha,alpha-trifluoro-m-tolyl)-
RN: 73013-18-0
InChIKey: DHELNOVLYSLOBD-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H9-Cl2-F3-N2-O3

Molecular Weight

  • 417.1691
 
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Names and Synonyms

Synonyms

  • 5-24-04-00368 (Beilstein Handbook Reference)
  • 6,8-Dichloro-4-oxo-2-(m-(alpha-trifluoro)tolyl)-3(4H)-quinazolineacetic acid
  • 6,8-Dichloro-4-oxo-2-(m-trifluoromethylphenyl)-3(4H)-quinazolineacetic acid
  • BRN 0861241

Systematic Name

  • 3(4H)-Quinazolineacetic acid, 6,8-dichloro-4-oxo-2-(alpha,alpha,alpha-trifluoro-m-tolyl)-

Registry Numbers

CAS Registry Number

  • 73013-18-0

System Generated Number

  • 0073013180

Structure Descriptors

InChI

1S/C17H9Cl2F3N2O3/c18-10-5-11-14(12(19)6-10)23-15(24(16(11)27)7-13(25)26)8-2-1-3-9(4-8)17(20,21)22/h1-6H,7H2,(H,25,26)

InChIKey

DHELNOVLYSLOBD-UHFFFAOYSA-N

Smiles

c1cc(cc(c1)C(F)(F)F)c2nc3c(cc(cc3Cl)Cl)c(=O)n2CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 350mg/kg (350mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 14, Pg. 357, 1979.