AZD5069

Ligand id: 8948

Name: AZD5069

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 158.56
Molecular weight 476.1
XLogP 1.69
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-[2-[(2,3-difluorophenyl)methylsulfanyl]-6-[(2R,3S)-3,4-dihydroxybutan-2-yl]oxypyrimidin-4-yl]azetidine-1-sulfonamide
Database Links
PubChem CID 56645576
Search Google for chemical match using the InChIKey QZECRCLSIGFCIO-RISCZKNCSA-N
Search Google for chemicals with the same backbone QZECRCLSIGFCIO
Search UniChem for chemical match using the InChIKey QZECRCLSIGFCIO-RISCZKNCSA-N
Search UniChem for chemicals with the same backbone QZECRCLSIGFCIO
Comments
AZD5069 is a novel, selective antagonist of the chemokine receptor, CXCR2. The structure shown here was drawn from that in [3], which specifies stereochemistry. This structure is identical to Example 47 in patent US7838675 [1]. PubChem records the structure with no specified stereochemistry (CID 59558839).
Small-molecule antagonists of CXCR2 are being developed for their potential to treat inflammatory conditions.