AZD4877

Ligand id: 7708

Name: AZD4877

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 10
Topological polar surface area 107.77
Molecular weight 503.24
XLogP 6.82
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(3-aminopropyl)-4-methyl-N-[2-methyl-1-[3-methyl-4-oxo-5-(phenylmethyl)-[1,2]thiazolo[5,4-d]pyrimidin-6-yl]propyl]benzamide
Synonyms
AZD 4877 | AZD-4877 | cc-722
Database Links
CAS Registry No. 1176760-49-8
ChEMBL Ligand CHEMBL1829433
PubChem CID 10368812
Search Google for chemical match using the InChIKey SMFXSYMLJDHGIE-UHFFFAOYSA-N
Search Google for chemicals with the same backbone SMFXSYMLJDHGIE
Search UniChem for chemical match using the InChIKey SMFXSYMLJDHGIE-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone SMFXSYMLJDHGIE
Comments
AZD4877 was developed as an inhibitor of the kinesin spindle protein KIF11 (aka Eg5) and was investigated as a potential treatment for haematopoietic and solid malignancies. This compound is now included in AstaZeneca's Open Innovation Pharmacology Toolbox.