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Substance Name: 5-Pyrimidinecarboxylic acid, 1,4-dihydro-4-oxo-2-((3-(trifluoromethyl)phenyl)amino)-
RN: 124013-94-1
InChIKey: MFBFPZNUKICXAF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H8-F3-N3-O3

Molecular Weight

  • 315.2062
 
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Names and Synonyms

Synonyms

  • 1,4-Dihydro-4-oxo-2-(3-((trifluoromethyl)phenyl)amino)-5-pyrimidinecarboxylic acid
  • 2-((3-Trifluoro)anilino)-6-oxo-5-pyrimidinecarboxylic acid

Systematic Name

  • 5-Pyrimidinecarboxylic acid, 1,4-dihydro-4-oxo-2-((3-(trifluoromethyl)phenyl)amino)-

Registry Numbers

CAS Registry Number

  • 124013-94-1

System Generated Number

  • 0124013941

Structure Descriptors

InChI

1S/C12H8F3N3O4/c13-12(14,15)7-5-6(1-2-8(7)18(20)21)9-3-4-10(22-9)11(16)17-19/h1-5,19H,(H2,16,17)

InChIKey

MFBFPZNUKICXAF-UHFFFAOYSA-N

Smiles

c1cc(c(cc1c2ccc(o2)C(=N)NO)C(F)(F)F)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 760mg/kg (760mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 37, Pg. 1780, 1989.
mouse LD50 oral > 3gm/kg (3000mg/kg)   Chemical and Pharmaceutical Bulletin. Vol. 37, Pg. 1780, 1989.