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Chemical structure of ARD-1676

GC73613

ARD-1676

Also known as 2-chloro-4-[(3S)-8-[4-[4-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxo-5,7-dihydropyrrolo[3,4-f]isoindol-6-yl]methyl]piperidine-1-carbonyl]phenyl]-3-methyl-2,8-diazaspiro[4.5]decan-2-yl]benzonitrile

ARD-1676 is an orally available androgen receptor (AR) PROTAC degrader, consisting of AR ligand and cereblon ligand

ChemicalCAS2632305-36-1MW788.33FormulaC44H46ClN7O5
CAS number
2632305-36-1
Molecular weight
788.33
Formula
C44H46ClN7O5
Solubility
DMSO : 100 mg/mL (126·85 mM; Need ultrasonic)
InChIKey
GAXWAKXJBZHVQF-ZVENJKCTSA-N
Catalogue number
GC73613
Brand
GLPBIO
Computed properties PubChem CID 156180706 · XLogP 4.9 · TPSA 137 Ų · H-bond donors 1
XLogP
4.9
TPSA
137 Ų
H-bond donors
1
H-bond acceptors
9
Rotatable bonds
6
Heavy atoms
57

SMILES C[C@H]1CC2(CCN(CC2)C3=CC=C(C=C3)C(=O)N4CCC(CC4)CN5CC6=CC7=C(C=C6C5)C(=O)N(C7=O)C8CCC(=O)NC8=O)CN1C9=CC(=C(C=C9)C#N)Cl

Computed descriptors from PubChem (CID 156180706), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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