AZD3463   Click here for help

GtoPdb Ligand ID: 7706

Synonyms: AZD-3463 | CS-1382 | HY-15609 | KB-154896
Compound class: Synthetic organic
Comment: AZD3463 was investigated as a treatement for non-small cell lung cancer (NSCLC) patients who have developed resistance to crizotinib. AZD3463 inhibits the tyrosine kinases ALK and IGF1R. This compound is included in AstaZeneca's Open Innovation Pharmacology Toolbox.
Click here for help
2D Structure
Click here for help
Click here for structure editor
Physico-chemical Properties
Click here for help
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 92.09
Molecular weight 448.18
XLogP 4.4
No. Lipinski's rules broken 0
Click here for help
Canonical SMILES COc1cc(ccc1Nc1ncc(c(n1)c1c[nH]c2c1cccc2)Cl)N1CCC(CC1)N
Isomeric SMILES COc1cc(ccc1Nc1ncc(c(n1)c1c[nH]c2c1cccc2)Cl)N1CCC(CC1)N
InChI InChI=1S/C24H25ClN6O/c1-32-22-12-16(31-10-8-15(26)9-11-31)6-7-21(22)29-24-28-14-19(25)23(30-24)18-13-27-20-5-3-2-4-17(18)20/h2-7,12-15,27H,8-11,26H2,1H3,(H,28,29,30)
Classification Click here for help
Compound class Synthetic organic
IUPAC Name Click here for help
Synonyms Click here for help
AZD-3463 | CS-1382 | HY-15609 | KB-154896
Database Links Click here for help
CAS Registry No. 1356962-20-3
GtoPdb PubChem SID 223366039
PubChem CID 56599293
Search Google for chemical match using the InChIKey GCYIGMXOIWJGBU-UHFFFAOYSA-N
Search Google for chemicals with the same backbone GCYIGMXOIWJGBU
UniChem Compound Search for chemical match using the InChIKey GCYIGMXOIWJGBU-UHFFFAOYSA-N
UniChem Connectivity Search for chemical match using the InChIKey GCYIGMXOIWJGBU-UHFFFAOYSA-N