ChemicalBook--->CAS DataBase List--->88149-94-4

88149-94-4

88149-94-4 Structure

88149-94-4 Structure
IdentificationBack Directory
[Name]

DUP-697
[CAS]

88149-94-4
[Synonyms]

BFMeT
DUP-697
DuP-697 Assay Reagent
5-BROMO-2-(4-FLUOROPHENYL)-3-(4-(METHYLSULFONYL)PHENYL)THIOPHENE
Thiophene, 5-bromo-2-(4-fluorophenyl)-3-[4-(methylsulfonyl)phenyl]-
[Molecular Formula]

C17H12BrFO2S2
[MDL Number]

MFCD02684527
[MOL File]

88149-94-4.mol
[Molecular Weight]

411.31
Chemical PropertiesBack Directory
[storage temp. ]

2-8°C
[solubility ]

DMF: 54 mg/ml; DMF:PBS (pH 7.2) (1:1): 0.5 mg/ml; DMSO: 15 mg/ml; Ethanol: 7 mg/ml
[form ]

White to off-white solid.
[color ]

White to off-white
Safety DataBack Directory
[Hazard Codes ]

Xi
[Risk Statements ]

36/37/38
[Safety Statements ]

26-36
Hazard InformationBack Directory
[Description]

DuP-697 is a member of the diaryl heterocycle group of selective COX-2 inhibitors which includes MK-966 (rofecoxib), SC-58125, and celecoxib. DuP-697 is a potent and time-dependent inhibitor of COX-2. When tested on isolated recombinant enzymes, DuP-697 is at least 50 times more potent in the inhibition of COX-2 than COX-1. The IC50 values for human recombinant COX-2 are 80 and 40 nM at 5 and 10 minutes, respectively. The IC50 for the inhibition of human recombinant COX-1 after the same time intervals is 9 μM. DuP-697 also attenuates the COX-1 inhibitory activity of non-selective COX inhibitors such as indomethacin.
[Uses]

DuP-697 is a thiophene that inhibits COX-2 and acts as a NSAID.
[Definition]

ChEBI: DuP 697 is a member of thiophenes.
[Biological Activity]

Potent and selective inhibitor of cyclooxygenase-2 (IC 50 values are 10 and 800 nM for COX-2 and COX-1 respectively). Inhibits prostaglandin synthesis and is anti-inflammatory in vivo . Orally active.
[storage]

Store at +4°C
[References]

[1] STACIA KARGMAN. Mechanism of selective inhibition of human prostaglandin G/H synthase-1 and -2 in intact cells[J]. Biochemical pharmacology, 1996, 52 7: Pages 1113-1125. DOI: 10.1016/0006-2952(96)00462-5
[2] K SEIBERT. Pharmacological manipulation of cyclo-oxygenase-2 in the inflamed hydronephrotic kidney.[J]. British Journal of Pharmacology, 1996, 117 6: 1016-1020. DOI: 10.1111/j.1476-5381.1996.tb16691.x
[3] MOTI ROSENSTOCK  Gilad R  Abraham Danon. PGHS-2 inhibitors, NS-398 and DuP-697, attenuate the inhibition of PGHS-1 by aspirin and indomethacin without altering its activity[J]. Biochimica et biophysica acta. Molecular and cell biology of lipids, 1999, 1440 1: Pages 127-137. DOI: 10.1016/s1388-1981(99)00105-5
Spectrum DetailBack Directory
[Spectrum Detail]

DUP-697(88149-94-4)1HNMR
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