Small Molecule celecoxib

URN urn:agi-cas:169590-42-5
Total Entities 0
Connectivity 956
Name celecoxib

Pathway cyclooxygenase mediated pathway of arachidonic acid metabolism

MedScan ID 1222933

Alias Celebra
4-(5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl)-Benzenesulfonamide
[(3)H]celecoxib
4-[[5-(p-tolyl)-3-(trifluoromethyl)-1H-pyrazol-1-yl]]benzenesulfonamide
CBX-butyryl
YM177
CBX-propionyl
CCRIS 8679
HSDB 7038
Onsenal
p-(5-p-Tolyl-3-(trifluoromethyl)pyrazol-1-yl)benzenesulfonamide
YM 177
SC 58635
Celecoxib
[(14)C]celecoxib
Celebrex

KEGG ID C07589

IUPAC Name 4-[5-(p-tolyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
4-[5-(p-tolyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide hydrochloride

InChIKey RZEKVGVHFLEQIL-UHFFFAOYSA-N
FLAHOJWKHLYECX-UHFFFAOYSA-N

Rotatable Bond Count 3

ChEBI ID 41423

CAS ID 169590-42-5
184007-95-2
194044-54-7

Molecular Weight 381.372170
417.833110

PubChem SID 205043
213764

PubChem CID 44144465
2662

XLogP 3.400000

Molecular Formula C17H14F3N3O2S
C17H15ClF3N3O2S

LinkUrl http://rgd.mcw.edu/rgdweb/ontology/annot.html?acc_id=CHEBI:41423&species=All#annot