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Substance Name: 1H-Pyrazole-4-acetic acid, 1-(6-fluoro-2-benzothiazolyl)-5-hydroxy-3-methyl-
RN: 92537-81-0
InChIKey: STODQWAIGKXIOB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H10-F-N3-O3-S

Molecular Weight

  • 307.304
 
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Names and Synonyms

Synonyms

  • 1-(6-Fluoro-2-benzothiazolyl)-5-hydroxy-3-methyl-1H-pyrazole-4-acetic acid
  • 2-(4'-Carboxymethyl-3'-methyl-5'-oxo-2'-pyrazolin-1'-yl)-6-fluorobenzothiazole
  • BRN 4550383

Systematic Name

  • 1H-Pyrazole-4-acetic acid, 1-(6-fluoro-2-benzothiazolyl)-5-hydroxy-3-methyl-

Registry Numbers

CAS Registry Number

  • 92537-81-0

System Generated Number

  • 0092537810

Structure Descriptors

InChI

1S/C13H10FN3O3S/c1-6-8(5-11(18)19)12(20)17(16-6)13-15-9-3-2-7(14)4-10(9)21-13/h2-4,20H,5H2,1H3,(H,18,19)

InChIKey

STODQWAIGKXIOB-UHFFFAOYSA-N

Smiles

Cc1c(c(n(n1)c2nc3ccc(cc3s2)F)O)CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported > 350mg/kg (350mg/kg)   Indian Journal of Chemistry, Section B: Organic Chemistry, Including Medicinal Chemistry. Vol. 23, Pg. 125, 1984.