Etifoxine hydrochlorideProduct ingredient for Etifoxine

Name
Etifoxine hydrochloride
Drug Entry
Etifoxine

Etifoxine is an anxiolytic and anticonvulsant drug developed by Hoechst in the 1960s. It is used in anxiety disorders and to promote peripheral nerve healing. It does not bind to the benzodiazepine receptor though the effects are similar to that of benzodiazepines. It is more effective than lorazepam as an anxiolytic, and has fewer side effects. Etifoxine has been associated with acute liver injury.

Accession Number
DBSALT002449
Structure
Synonyms
Etifoxine HCl
UNII
NBL8010WH5
CAS Number
56776-32-0
Weight
Average: 337.244
Monoisotopic: 336.079618622
Chemical Formula
C17H18Cl2N2O
InChI Key
SCBJXEBIMVRTJE-UHFFFAOYSA-N
InChI
InChI=1S/C17H17ClN2O.ClH/c1-3-19-16-20-15-10-9-13(18)11-14(15)17(2,21-16)12-7-5-4-6-8-12;/h4-11H,3H2,1-2H3,(H,19,20);1H
IUPAC Name
6-chloro-N-ethyl-4-methyl-4-phenyl-4H-3,1-benzoxazin-2-amine hydrochloride
SMILES
Cl.CCNC1=NC2=CC=C(Cl)C=C2C(C)(O1)C1=CC=CC=C1
ChemSpider
149958
Predicted Properties
PropertyValueSource
Water Solubility0.00216 mg/mLALOGPS
logP4.52ALOGPS
logP4.59Chemaxon
logS-5.1ALOGPS
pKa (Strongest Basic)5.18Chemaxon
Physiological Charge0Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area33.62 Å2Chemaxon
Rotatable Bond Count2Chemaxon
Refractivity87.23 m3·mol-1Chemaxon
Polarizability32.25 Å3Chemaxon
Number of Rings3Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon