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PD-166866

CAT: 1568-C13447-02Size: 50 mgDry Ice: YesHazardous: No
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CAT#:1568-C13447-02Size:50 mg
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CAS Number
192705-79-6
SKU
C13447-10mg
Target
FGFR
Applications
Protein Tyrosine Kinase
Smiles
CC (C) (C) NC (=O) NC1=C (C=C2C=NC (=NC2=N1) N) C3=CC (=CC (=C3) OC) OC
Molecular Formula
C20H24N6O3
Additionnal Information
PD-166866 is a synthetic molecule inhibiting the tyrosin kinase action of FGFR1, shows a very high selectivity towards FGFR1 and inhibits the auto-phosphorylation activity of FGRF1.
Storage Conditions
2 years -80 in solvent

Chemical Information

PD-166866

PD-166866 is a member of the class of pyridopyrimidines that is pyrido[2,3-d]pyrimidine substituted by an amino group at position 2, 3,5-dimethoxyphenyl group at position 6, and by a (tert-butylcarbamoyl)nitrilo group at position 7. It is a selective ATP competitive inhibitor of the human fibroblast growth factor-1 receptor (FGFR1) tyrosine kinase with an IC50 of 52.4 nM. It has a role as an antineoplastic agent, an angiogenesis inhibitor, an EC 2.7.10.1 (receptor protein-tyrosine kinase) inhibitor and an apoptosis inducer. It is a pyridopyrimidine, a member of ureas, a primary arylamine, a dimethoxybenzene and a biaryl.

CAS Number192705-79-6
PubChem CID5328127
IUPAC Name1-[2-amino-6-(3,5-dimethoxyphenyl)pyrido[2,3-d]pyrimidin-7-yl]-3-tert-butylurea
Molecular FormulaC20H24N6O3
Molecular Weight396.4
XLogP2.3
Topological Polar Surface Area124
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Heavy Atom Count29
Formal Charge0
Complexity545
SMILES
CC(C)(C)NC(=O)NC1=C(C=C2C=NC(=NC2=N1)N)C3=CC(=CC(=C3)OC)OC
InChI
InChI=1S/C20H24N6O3/c1-20(2,3)26-19(27)25-17-15(8-12-10-22-18(21)24-16(12)23-17)11-6-13(28-4)9-14(7-11)29-5/h6-10H,1-5H3,(H4,21,22,23,24,25,26,27)
InChIKey
NHJSWORVNIOXIT-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of PD-166866
CAS: 192705-79-6
CID: 5328127
Formula: C20H24N6O3
MW: 396.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight396.4
XLogP32.3
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count7
Rotatable Bond Count5
Exact Mass396.19098865
Monoisotopic Mass396.19098865
Topological Polar Surface Area124 Ų
Heavy Atom Count29
Formal Charge0
Complexity545
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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