AZD3778

Ligand id: 7679

Name: AZD3778

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 7
Topological polar surface area 87.33
Molecular weight 525.13
XLogP 4.75
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[4-(3,4-dichlorophenoxy)piperidin-1-yl]-N-(4-methylphenyl)sulfonylpiperidine-1-carboxamide
Synonyms
AZD 3778 | AZD-3778
Database Links
CAS Registry No. 1032129-23-9 (source: SciFinder)
ChEMBL Ligand CHEMBL2158814
PubChem CID 11753159
Search Google for chemical match using the InChIKey QVLZVRFIGXNZMN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone QVLZVRFIGXNZMN
Search UniChem for chemical match using the InChIKey QVLZVRFIGXNZMN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone QVLZVRFIGXNZMN
Comments
AZD3778 was an investigational chemokine receptor antagonist, being evaluated as a potentila treatment for asthma. However, the compound failed to show efficacy and development project was halted. A poor level of target engagement and sub-optimal pharmacodynamic activity due to the pharmacokinetic properties of the compound were likely causes. This compound is discussed in the AZ 2014 review paper [2].