Parecoxib-[d5]

General Information
Catalog: BLP-003736
Molecular Formula: C19H13D5N2O4S
Molecular Weight: 375.45
Related CAS: 198470-84-7 (unlabelled)
Description Parecoxib-[d5], is the labelled analogue of Parecoxib. Parecoxib is a selective COX-2 inhibitor and a prodrug of valdecoxib approved for the control of short term perioperative pain.
Synonyms Parecoxib D5
IUPAC Name 2,2,3,3,3-pentadeuterio-N-[4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)phenyl]sulfonylpropanamide
Canonical SMILES CCC(=O)NS(=O)(=O)C1=CC=C(C=C1)C2=C(ON=C2C3=CC=CC=C3)C
InChI InChI=1S/C19H18N2O4S/c1-3-17(22)21-26(23,24)16-11-9-14(10-12-16)18-13(2)25-20-19(18)15-7-5-4-6-8-15/h4-12H,3H2,1-2H3,(H,21,22)/i1D3,3D2
InChI Key TZRHLKRLEZJVIJ-WNWXXORZSA-N
Purity >98%
Solubility Soluble in DMSO, Methanol
Appearance Off-white Solid
Storage Store at-20°C

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