Imrecoxib structure, CAS 395683-14-4

Imrecoxib

CAS Number395683-14-4

Synonyms3-(4-Methylphenyl)-4-[4-(methylsulfonyl)phenyl]-1-propyl-1,5-dihydro-2H-pyrrol-2-one; 4-(4-(methylsulfonyl)phenyl)-1-propyl-3-(p-tolyl)-1H-pyrrol-2(5H)-one; 4-(4-(methylsulfonyl)phenyl)-1-propyl-3-(p-tolyl)-1,5-dihydro-2H-pyrrol-2-one

Molecular FormulaC21H23O3N1S1

Molecular Weight369.48

Purity

Density1.2±0.1 g/cm3

Boiling Point604.1±55.0 °C at 760 mmHg

Melting Point

Flash Point

Appearance

EINECS

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Symbol

Signal Word

Cat. No.: 2A-4201245 Purity:
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Quality Control of [ 395683-14-4 ] SDS Specification MoL

Chemical & Physical Properties
CAS Number395683-14-4
Catalog No.2A-4201245
Chinese Name艾瑞昔布
Synonyms3-(4-Methylphenyl)-4-[4-(methylsulfonyl)phenyl]-1-propyl-1,5-dihydro-2H-pyrrol-2-one; 4-(4-(methylsulfonyl)phenyl)-1-propyl-3-(p-tolyl)-1H-pyrrol-2(5H)-one; 4-(4-(methylsulfonyl)phenyl)-1-propyl-3-(p-tolyl)-1,5-dihydro-2H-pyrrol-2-one
Molecular FormulaC21H23O3N1S1
Molecular Weight369.48
Density1.2±0.1 g/cm3
Boiling Point604.1±55.0 °C at 760 mmHg
Storage Condition2-8°C, dry, sealed
ApplicationImrecoxib (BAP-909) is a selective cyclooxygenase 2 (COX-2) inhibitor with an IC50 value of 18 nM. It can also inhibit COX1 activity with an IC50 value of 115 nM. Imrecoxib (BAP-909) Imrecoxib has ant
PubChem ID16786344
MDL NumberMFCD09832697
SMILESCCCN1CC(c2ccc(S(C)(=O)=O)cc2)=C(c2ccc(C)cc2)C1=O
InChIInChI=1S/C21H23NO3S/c1-4-13-22-14-19(16-9-11-18(12-10-16)26(3,24)25)20(21(22)23)17-7-5-15(2)6-8-17/h5-12H,4,13-14H2,1-3H3
InChI KeyAXMZZGKKZDJGAZ-UHFFFAOYSA-N
MSDSmsds/202955_1_395683_14_4.pdf
Transport InfoProduct name: Imrecoxib
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