bromoenol lactone

Ligand id: 5149

Name: bromoenol lactone

Abbreviated name: BEL

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 1
Topological polar surface area 26.3
Molecular weight 316.01
XLogP 6.7
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(6E)-6-(bromomethylidene)-3-(naphthalen-1-yl)oxan-2-one
Synonyms
bromoenolactone
Database Links
CAS Registry No. 88070-98-8
ChEMBL Ligand CHEMBL6206
PubChem CID 5940264
Search Google for chemical match using the InChIKey BYUCSFWXCMTYOI-ZRDIBKRKSA-N
Search Google for chemicals with the same backbone BYUCSFWXCMTYOI
Search UniChem for chemical match using the InChIKey BYUCSFWXCMTYOI-ZRDIBKRKSA-N
Search UniChem for chemicals with the same backbone BYUCSFWXCMTYOI