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Chemical structure of CC618

GC70491

CC618

Also known as 4-methyl-2-[4-(trifluoromethyl)phenyl]-N-[2-[[5-(trifluoromethyl)-2-pyridinyl]sulfonyl]ethyl]-1,3-thiazole-5-carboxamide

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

ChemicalCAS1680204-90-3MW523.47FormulaC20H15F6N3O3S2
CAS number
1680204-90-3
Molecular weight
523.47
Formula
C20H15F6N3O3S2
InChIKey
AZZXDJUUKNGRAK-UHFFFAOYSA-N
Catalogue number
GC70491
Brand
GLPBIO
Computed properties PubChem CID 118734332 · XLogP 4.6 · TPSA 126 Ų · H-bond donors 1
XLogP
4.6
TPSA
126 Ų
H-bond donors
1
H-bond acceptors
12
Rotatable bonds
6
Heavy atoms
34

SMILES CC1=C(SC(=N1)C2=CC=C(C=C2)C(F)(F)F)C(=O)NCCS(=O)(=O)C3=NC=C(C=C3)C(F)(F)F

Computed descriptors from PubChem (CID 118734332), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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