ChemicalBook--->CAS DataBase List--->1469976-70-2

1469976-70-2

1469976-70-2 Structure

1469976-70-2 Structure
IdentificationBack Directory
[Name]

mPGES1-IN-3
[CAS]

1469976-70-2
[Synonyms]

mPGES1-IN-3
mPGES1IN3,mPGES-1-IN-3,mPGES1 IN 3
1H-[1,4]Dioxino[2,3-e]benzimidazole-5-carboxamide, 2-[(2-chloro-6-fluorophenyl)amino]-N-[3-fluoro-5-(trifluoromethyl)phenyl]-7,8-dihydro-1-methyl-
[Molecular Formula]

C24H16ClF5N4O3
[MDL Number]

MFCD30747869
[MOL File]

1469976-70-2.mol
[Molecular Weight]

538.85
Chemical PropertiesBack Directory
[density ]

1.58±0.1 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

Soluble in DMSO
[pka]

10.38±0.70(Predicted)
Hazard InformationBack Directory
[Uses]

mPGES1-IN-3 (Compound 17d) is a potent and selective microsomal prostaglandin E2 synthase-1 (mPGES-1) inhibitor, which exhibits excellent mPGES-1 enzyme (IC50: 8 nM), cell (A549 IC50: 16.24 nM) and human whole blood potency (IC50: 249.9 nM)[1].
[References]

[1] Muthukaman N, et al. Discovery of 2-((2-chloro-6-fluorophenyl)amino)-N-(3-fluoro-5-(trifluoromethyl)phenyl)-1-methyl-7,8-dihydro-1H-[1,4]dioxino[2',3':3,4]benzo[1,2-d]imidazole-5-carboxamide as potent, selective and efficacious microsomal prostaglandin E2 DOI:10.1016/j.bmcl.2016.10.079
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