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Chemical structure of AGN 195183

GC35265

AGN 195183

Also known as 4-[(4-chloro-3-hydroxy-5,5,8,8-tetramethyl-6,7-dihydronaphthalene-2-carbonyl)amino]-2,6-difluorobenzoic acid

AGN 195183 (IRX-5183) is a potent and selective agonist of RARα (Kd=3 nM) with improved binding selectivity relative to AGN 193836· AGN 195183 has no activity on RARβ/γ

ChemicalCAS367273-07-2MW437.86FormulaC22H22ClF2NO4
CAS number
367273-07-2
Molecular weight
437.86
Formula
C22H22ClF2NO4
Solubility
DMSO： ≥ 62 mg/mL (141·60 mM)
InChIKey
PNAWUIKCVQSLFG-UHFFFAOYSA-N
Catalogue number
GC35265
Brand
GLPBIO
Computed properties PubChem CID 9867758 · XLogP 6.4 · TPSA 86.6 Ų · H-bond donors 3
XLogP
6.4
TPSA
86.6 Ų
H-bond donors
3
H-bond acceptors
6
Rotatable bonds
3
Heavy atoms
30

SMILES CC1(CCC(C2=C1C=C(C(=C2Cl)O)C(=O)NC3=CC(=C(C(=C3)F)C(=O)O)F)(C)C)C

Computed descriptors from PubChem (CID 9867758), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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