1'-acetoxychavicol acetate

Ligand id: 6298

Name: 1'-acetoxychavicol acetate

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 6
Topological polar surface area 52.6
Molecular weight 234.09
XLogP 3.01
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
[4-[(1S)-1-acetyloxyprop-2-enyl]phenyl] acetate
Database Links
CAS Registry No. 52946-22-2 (source: SciFinder)
ChEMBL Ligand CHEMBL323727
PubChem CID 119104
Search Google for chemical match using the InChIKey JAMQIUWGGBSIKZ-ZDUSSCGKSA-N
Search Google for chemicals with the same backbone JAMQIUWGGBSIKZ
Search UniChem for chemical match using the InChIKey JAMQIUWGGBSIKZ-ZDUSSCGKSA-N
Search UniChem for chemicals with the same backbone JAMQIUWGGBSIKZ