For research use only. Not for therapeutic Use.
Celecoxib-d3(Cat No.:S000417) is a deuterated version of celecoxib, where three hydrogen atoms are replaced with deuterium. This modification is designed to enhance the drug’s metabolic stability, aiding in detailed pharmacokinetic studies. Celecoxib is a nonsteroidal anti-inflammatory drug (NSAID) specifically classified as a COX-2 inhibitor, used primarily to relieve pain and inflammation in conditions like arthritis. It selectively inhibits the enzyme cyclooxygenase-2 (COX-2), which plays a key role in inflammation. The deuterated version, Celecoxib-d3, helps researchers understand how the drug is metabolized in the body, potentially leading to improved therapeutic efficacy and safety.
Catalog Number | S000417 |
CAS Number | 544686-18-2 |
Molecular Formula | C17H11D3F3N3O2S |
Purity | ≥95% |
Target | COX |
IUPAC Name | 4-[5-[4-(trideuteriomethyl)phenyl]-3-(trifluoromethyl)pyrazol-1-yl]benzenesulfonamide |
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)/i1D3 |
InChIKey | RZEKVGVHFLEQIL-FIBGUPNXSA-N |
SMILES | CC1=CC=C(C=C1)C2=CC(=NN2C3=CC=C(C=C3)S(=O)(=O)N)C(F)(F)F |