Propranolol hydrochlorideProduct ingredient for Propranolol

Name
Propranolol hydrochloride
Drug Entry
Propranolol

Propranolol is a racemic mixture of 2 enantiomers where the S(-)-enantiomer has approximately 100 times the binding affinity for beta adrenergic receptors.9 Propranolol is used to treat a number of conditions but most commonly is used for hypertension.8,9,10

Propranolol was granted FDA approval on 13 November 1967.9

Accession Number
DBSALT000549
Structure
Synonyms
Propranolol HCl
UNII
F8A3652H1V
CAS Number
318-98-9
Weight
Average: 295.804
Monoisotopic: 295.13390666
Chemical Formula
C16H22ClNO2
InChI Key
ZMRUPTIKESYGQW-UHFFFAOYSA-N
InChI
InChI=1S/C16H21NO2.ClH/c1-12(2)17-10-14(18)11-19-16-9-5-7-13-6-3-4-8-15(13)16;/h3-9,12,14,17-18H,10-11H2,1-2H3;1H
IUPAC Name
1-(naphthalen-1-yloxy)-3-[(propan-2-yl)amino]propan-2-ol hydrochloride
SMILES
Cl.CC(C)NCC(O)COC1=CC=CC2=CC=CC=C12
PubChem Compound
62882
ChemSpider
56610
ChEBI
8500
ChEMBL
CHEMBL1671
Wikipedia
Propranolol
Predicted Properties
PropertyValueSource
Water Solubility0.0794 mg/mLALOGPS
logP3.03ALOGPS
logP2.58Chemaxon
logS-3.5ALOGPS
pKa (Strongest Acidic)14.09Chemaxon
pKa (Strongest Basic)9.67Chemaxon
Physiological Charge1Chemaxon
Hydrogen Acceptor Count3Chemaxon
Hydrogen Donor Count2Chemaxon
Polar Surface Area41.49 Å2Chemaxon
Rotatable Bond Count6Chemaxon
Refractivity76.83 m3·mol-1Chemaxon
Polarizability29.84 Å3Chemaxon
Number of Rings2Chemaxon
Bioavailability1Chemaxon
Rule of FiveYesChemaxon
Ghose FilterYesChemaxon
Veber's RuleNoChemaxon
MDDR-like RuleNoChemaxon