Description
Key facts
CAS number:169590-42-5,
Form:SolidSee storage information,
Molecular weight:381.4 Da,
Molecular formula:C17H14F3N3O2S,
PubChem:2662,
Nature:Synthetic,
Solubility:Soluble in DMSO to 25 mMSoluble in ethanol to 50 mM,
Biochemical name:Celecoxib,
Biological description:Selective COX-2 inhibitor (IC50 values are 15 and 0.04 μM for COX-1 and COX-2 respectively). Non-steroidal anti-inflammatory drug. Enhances tumor cell apoptosis in vivo. Orally active.,
Canonical smiles:CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F,
InChi:InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25),
InChiKey:RZEKVGVHFLEQIL-UHFFFAOYSA-N,
IUPAC Name:4-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide
Properties and Storage Information:
Shipped at conditions-Ambient - Can Ship with Ice, Appropriate short-term storage conditions-Ambient, Appropriate long-term storage conditions-Ambient, Storage information-The product can be stored for up to 12 months