Chlophedianol hydrochlorideProduct ingredient for Clofedanol

Name
Chlophedianol hydrochloride
Drug Entry
Clofedanol

Clofedanol is a centrally-acting cough suppressant available in Canada under the trade name Ulone. It is not available in the United States.

Accession Number
DBSALT001414
Structure
Synonyms
Chlophedianol HCl
UNII
69QQ58998Y
CAS Number
511-13-7
Weight
Average: 326.26
Monoisotopic: 325.1000197
Chemical Formula
C17H21Cl2NO
InChI Key
XYGSFNHCFFAJPO-UHFFFAOYSA-N
InChI
InChI=1S/C17H20ClNO.ClH/c1-19(2)13-12-17(20,14-8-4-3-5-9-14)15-10-6-7-11-16(15)18;/h3-11,20H,12-13H2,1-2H3;1H
IUPAC Name
1-(2-chlorophenyl)-3-(dimethylamino)-1-phenylpropan-1-ol hydrochloride
SMILES
Cl.CN(C)CCC(O)(C1=CC=CC=C1)C1=CC=CC=C1Cl
ChemSpider
75633
ChEBI
31392
ChEMBL
CHEMBL1200972
Wikipedia
Clofedanol
Predicted Properties
PropertyValueSource
Water Solubility0.0621 mg/mLALOGPS
logP3.51ALOGPS
logP3.46Chemaxon
logS-3.7ALOGPS
pKa (Strongest Acidic)13.18Chemaxon
pKa (Strongest Basic)8.87Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count2Chemaxon
Hydrogen Donor Count1Chemaxon
Polar Surface Area23.47 Å2Chemaxon
Rotatable Bond Count5Chemaxon
Refractivity84.94 m3·mol-1Chemaxon
Polarizability31.65 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleYesChemaxon
MDDR-like RuleNoChemaxon