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Chemical structure of GZD824

GC10915

GZD824

Also known as methanesulfonic acid;4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-[2-(1H-pyrazolo[5,4-b]pyridin-5-yl)ethynyl]benzamide

Olverembatinib (GZD824) dimesylate is a potent and orally active pan-Bcr-Abl inhibitor· GZD824 potently inhibits a broad spectrum of Bcr-Abl mutants· GZD824 strongly inhibits native Bcr-Abl and Bcr-AblT315I with IC50s of 0·34 nM and 0·68 nM, respectively· GZD824 has antitumor activity

ChemicalCAS1421783-64-3MW724.77FormulaC29H27F3N6O·2CH4O3S
CAS number
1421783-64-3
Molecular weight
724.77
Formula
C29H27F3N6O·2CH4O3S
Solubility
≥ 36·25mg/mL in DMSO
InChIKey
LEVIGHXVOVROGW-UHFFFAOYSA-N
Catalogue number
GC10915
Brand
GLPBIO
Computed properties PubChem CID 71519689 · TPSA 203 Ų · H-bond donors 4 · H-bond acceptors 14
TPSA
203 Ų
H-bond donors
4
H-bond acceptors
14
Rotatable bonds
6
Heavy atoms
49

SMILES CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)CN3CCN(CC3)C)C(F)(F)F)C#CC4=CC5=C(NN=C5)N=C4.CS(=O)(=O)O.CS(=O)(=O)O

Computed descriptors from PubChem (CID 71519689), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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