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Chemical structure of GZD856 formic

GC62453

GZD856 formic

Also known as formic acid;4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-(2-pyrazolo[1,5-a]pyrimidin-6-ylethynyl)benzamide

GZD856 formic is a potent and orally active PDGFRα/β inhibitor, with IC50s of 68·6 and 136·6 nM, respectively· GZD856 formic is also a Bcr-AblT315I inhibitor, with IC50s of 19·9 and 15·4?nM for native Bcr-Abl and the T315I mutant· GZD856 formic has antitumor activity

ChemicalCAS2804039-78-7MW578.58FormulaC30H29F3N6O3
CAS number
2804039-78-7
Molecular weight
578.58
Formula
C30H29F3N6O3
InChIKey
CZBBDTJTQDJXAO-UHFFFAOYSA-N
Catalogue number
GC62453
Brand
GLPBIO
Computed properties PubChem CID 155981976 · TPSA 103 Ų · H-bond donors 2 · H-bond acceptors 10
TPSA
103 Ų
H-bond donors
2
H-bond acceptors
10
Rotatable bonds
6
Heavy atoms
42

SMILES CC1=C(C=C(C=C1)C(=O)NC2=CC(=C(C=C2)CN3CCN(CC3)C)C(F)(F)F)C#CC4=CN5C(=CC=N5)N=C4.C(=O)O

Computed descriptors from PubChem (CID 155981976), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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