stiripentol

Ligand id: 5469

Name: stiripentol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 38.69
Molecular weight 234.13
XLogP 3.16
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (EMA (2007))
IUPAC Name
(1E)-1-(2H-1,3-benzodioxol-5-yl)-4,4-dimethylpent-1-en-3-ol
International Nonproprietary Names
INN number INN
3760 stiripentol
Synonyms
BCX 2600 | Diacomit ®
Database Links
CAS Registry No. 49763-96-4 (source: Scifinder)
ChEMBL Ligand CHEMBL1983350
PubChem CID 5311454
Search Google for chemical match using the InChIKey IBLNKMRFIPWSOY-FNORWQNLSA-N
Search Google for chemicals with the same backbone IBLNKMRFIPWSOY
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Search UniChem for chemical match using the InChIKey IBLNKMRFIPWSOY-FNORWQNLSA-N
Search UniChem for chemicals with the same backbone IBLNKMRFIPWSOY
Wikipedia Stiripentol
Comments
Stiripentol is a mixture of enantiomers. The structure shown here does not specify stereochemistry at the chiral centres and therefore represents the mixture. Click here to view the PubChem records for associated stereoisomers.