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Desmethyl Celecoxib

Names

[ CAS No. ]:
170569-87-6

[ Name ]:
Desmethyl Celecoxib

[Synonym ]:
4-[5-phenyl-3-trifluoromethyl-1H-pyrazol-1-yl]benzene-sulfonamide
4-[5-phenyl-3-(trifluoromethyl) -1H-pyrazol-1-yl] benzenesulfonamide
4-[5-Phenyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]benzenesulfonamide
Benzenesulfonamide, 4-[5-phenyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]-
4-[5-phenyl-3-(trifluoromethyl)-1H-pyrazol-1-yl] benzenesulfonamide
1-(4-sulfonamidophenyl)-5-phenyl-3-(trifluoromethyl)-1H-pyrazole
Desmethyl Celecoxib
4-[5-phenyl-3-(trifluoromethyl)-1H-pyrazol-1yl]benzenesulfonamide
1-HEXADECANOYL-2-(P-NITROPHENOXYSUCCINOYL)-SN-GLYCERYL-3-PHOSPHORYLCHOLINE

Biological Activity

[Description]:

Desmethyl Celecoxib (compound 3b) is a selective cyclooxygenase-2 (COX-2) inhibitor (IC50=32 nM) with anti-inflammatory activities. Desmethyl Celecoxib is an analog of Celecoxib and with the optimal yield of 75%[1].

[Related Catalog]:

Research Areas >> Inflammation/Immunology
Signaling Pathways >> Immunology/Inflammation >> COX

[Target]

COX-2:32 nM (IC50)


[References]

[1]. Vinay Kumar Sthalam, et al. An Integrated Continuous Flow Micro-Total Ultrafast Process System (μ-TUFPS) for the Synthesis of Celecoxib and Other Cyclooxygenase Inhibitors. RETURN TO ISSUEPREVARTICLENEXT

Chemical & Physical Properties

[ Density]:
1.5±0.1 g/cm3

[ Boiling Point ]:
522.5±60.0 °C at 760 mmHg

[ Molecular Formula ]:
C16H12F3N3O2S

[ Molecular Weight ]:
367.346

[ Flash Point ]:
269.8±32.9 °C

[ Exact Mass ]:
367.060242

[ PSA ]:
86.36000

[ LogP ]:
3.75

[ Vapour Pressure ]:
0.0±1.4 mmHg at 25°C

[ Index of Refraction ]:
1.613

Safety Information

[ Hazard Codes ]:
Xi

Related Compounds