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Chemical structure of AZD-0284

GC31880

AZD-0284

Also known as (1R)-2-acetyl-N-[4-(1,1,1,3,3,3-hexafluoro-2-hydroxypropan-2-yl)phenyl]-5-methylsulfonyl-1,3-dihydroisoindole-1-carboxamide

AZD-0284 is a selective inverse agonist of the nuclear receptor RORγ

ChemicalCAS2101291-07-8MW524.43FormulaC21H18F6N2O5S
CAS number
2101291-07-8
Molecular weight
524.43
Formula
C21H18F6N2O5S
Solubility
DMSO ： 100 mg/mL (190·68 mM)
InChIKey
QYYZXEPEVBXNNA-QGZVFWFLSA-N
Catalogue number
GC31880
Brand
GLPBIO
Computed properties PubChem CID 129205086 · XLogP 2.3 · TPSA 112 Ų · H-bond donors 2
XLogP
2.3
TPSA
112 Ų
H-bond donors
2
H-bond acceptors
11
Rotatable bonds
4
Heavy atoms
35

SMILES CC(=O)N1CC2=C([C@@H]1C(=O)NC3=CC=C(C=C3)C(C(F)(F)F)(C(F)(F)F)O)C=CC(=C2)S(=O)(=O)C

Computed descriptors from PubChem (CID 129205086), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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