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GZD856 formic

CAT: 0013-GTR19185213-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19185213-02Size:50 mg
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Description
GZD856 formic is a potent, orally bioavailable small molecule inhibitor targeting PDGFRα/β and Bcr-Abl, including the resistant T315I mutant. It demonstrates significant antitumor efficacy in preclinical models, making it a valuable research tool for studying tyrosine kinase-driven cancers in both in vitro and in vivo settings.
CAS Number
2804039-78-7
Field of Research
Cardiovascular Research, Cell Biology, Signal Transduction
Smiles
C (O) =O.C (C1=C (C (F) (F) F) C=C (NC (=O) C2=CC (C#CC3=CN4C (N=C3) =CC=N4) =C (C) C=C2) C=C1) N5CCN (C) CC5
Molecular Formula
C30H29F3N6O3
Molecular Weight
578.58
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

GZD856 formic
CAS Number2804039-78-7
PubChem CID155981976
IUPAC Nameformic acid;4-methyl-N-[4-[(4-methylpiperazin-1-yl)methyl]-3-(trifluoromethyl)phenyl]-3-(2-pyrazolo[1,5-a]pyrimidin-6-ylethynyl)benzamide
Molecular FormulaC30H29F3N6O3
Molecular Weight578.6
Topological Polar Surface Area103
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count6
Heavy Atom Count42
Formal Charge0
Complexity920
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
InChI
InChI=1S/C29H27F3N6O.CH2O2/c1-20-3-5-23(15-22(20)6-4-21-17-33-27-9-10-34-38(27)18-21)28(39)35-25-8-7-24(26(16-25)29(30,31)32)19-37-13-11-36(2)12-14-37;2-1-3/h3,5,7-10,15-18H,11-14,19H2,1-2H3,(H,35,39);1H,(H,2,3)
InChIKey
CZBBDTJTQDJXAO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of GZD856 formic
CAS: 2804039-78-7
CID: 155981976
Formula: C30H29F3N6O3
MW: 578.6
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight578.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count10
Rotatable Bond Count6
Exact Mass578.22532329
Monoisotopic Mass578.22532329
Topological Polar Surface Area103 Ų
Heavy Atom Count42
Formal Charge0
Complexity920
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

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