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Chemical structure of GDC-2992

GC26840

GDC-2992

Also known as N-[3-(3-chloro-4-cyanophenoxy)-2,2,4,4-tetramethylcyclobutyl]-4-[4-[[4-[2-[(3S)-2,6-dioxopiperidin-3-yl]-1-oxophthalazin-6-yl]piperazin-1-yl]methyl]piperidin-1-yl]benzamide

GDC-2992 is a selective and oral AR (androgen receptor) degrader that inhibits the proliferation of tumor cells overexpressing AR, degrades AR (DC50 = 2·7 nM) and inhibits proliferation (IC50 = 9·7 nM) in VCaP cells, and can be used for oncology studies in denuded resistant prostate cancer (CRPC)

ChemicalCAS2753651-10-2MW819.39FormulaC45H51ClN8O5
CAS number
2753651-10-2
Molecular weight
819.39
Formula
C45H51ClN8O5
InChIKey
PAELKDHSDBUTGE-CWFKGWKDSA-N
Catalogue number
GC26840
Brand
GLPBIO
Computed properties PubChem CID 169012814 · XLogP 6.2 · TPSA 151 Ų · H-bond donors 2
XLogP
6.2
TPSA
151 Ų
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
9
Heavy atoms
59

SMILES CC1(C(C(C1OC2=CC(=C(C=C2)C#N)Cl)(C)C)NC(=O)C3=CC=C(C=C3)N4CCC(CC4)CN5CCN(CC5)C6=CC7=C(C=C6)C(=O)N(N=C7)[C@H]8CCC(=O)NC8=O)C

Computed descriptors from PubChem (CID 169012814), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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