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About This Item
Empirical Formula (Hill Notation):
C13H18N2O5S
CAS Number:
Molecular Weight:
314.36
MDL number:
UNSPSC Code:
12352200
PubChem Substance ID:
NACRES:
NA.77
Quality Level
Assay
≥98% (HPLC)
form
solid
color
off-white
mp
127-128 °C
solubility
DMSO: >5 mg/mL
H2O: insoluble
SMILES string
CS(=O)(=O)Nc1ccc(cc1OC2CCCCC2)[N+]([O-])=O
InChI
1S/C13H18N2O5S/c1-21(18,19)14-12-8-7-10(15(16)17)9-13(12)20-11-5-3-2-4-6-11/h7-9,11,14H,2-6H2,1H3
InChI key
KTDZCOWXCWUPEO-UHFFFAOYSA-N
Gene Information
human ... ALOX5(240), CYP19A1(1588), PTGS1(5742), PTGS2(5743)
mouse ... Ptgs2(19225)
Application
NS-398 has been used as a cyclooxygenase-2 (COX2) inhibitor to study its effects on:
- the cardiac rate in zebrafish embryos
- apoptosis and hypoxia/reoxygenation in rat cardiomyocytes
- the lipopolysaccharide (LPS) induced anorexia in rats
Biochem/physiol Actions
NS-398 belongs to the non-steroidal anti-inflammatory drug (NSAID) family. It exhibits anti-inflammatory, analgesic, and anti-pyretic properties.
Selective cyclooxygenase-2 (COX-2) inhibitor.
Storage Class Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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