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1680204-90-3

1680204-90-3 Structure

1680204-90-3 Structure
IdentificationBack Directory
[Name]

CC-618
[CAS]

1680204-90-3
[Synonyms]

CC-618
5-Thiazolecarboxamide, 4-methyl-2-[4-(trifluoromethyl)phenyl]-N-[2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]ethyl]-
[Molecular Formula]

C20H15F6N3O3S2
[MOL File]

1680204-90-3.mol
[Molecular Weight]

523.47
Chemical PropertiesBack Directory
[density ]

1.466±0.06 g/cm3(Predicted)
[form ]

Solid
[pka]

9.39±0.46(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Description]

CC618 is a potent and selective PPARβ/δ antagonist. CC618 selectively antagonizes agonist-induced PPARβ/δ activity with an IC50 = 10.0 μM. The treatment of PPARβ/δ with CC618 leads to a covalent modification of Cys249, located centrally in the PPARβ/δ ligand binding pocket, corresponding to the conversion of its thiol moiety to a 5-trifluoromethyl-2-pyridylthioether.
[Uses]

CC618 is a selective peroxisome proliferator-activated receptor (PPARβ/δ) antagonist that exhibits antagonism by covalently binding to PPARβ/δ receptors[1].
[References]

[1] Kaupang ?, et al. Synthesis, biological evaluation and molecular modeling studies of the PPARβ/δ antagonist CC618. Eur J Med Chem. 2015 Apr 13;94:229-36. DOI:10.1016/j.ejmech.2015.03.006
Spectrum DetailBack Directory
[Spectrum Detail]

CC-618(1680204-90-3)1HNMR
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