Bevantolol hydrochlorideProduct ingredient for Bevantolol
- Name
- Bevantolol hydrochloride
- Drug Entry
- Bevantolol
Bevantolol is a beta-1 adrenoceptor antagonist that has been shown to be as effective as other beta blockers for the treatment of angina pectoris and hypertension. Mechanism of Action Animal experiments confirm both agonist and antagonist effects on alpha-receptors, in addition to antagonist activity at beta-1 receptors.
- Accession Number
- DBSALT002868
- Structure
Structure for Bevantolol hydrochloride (DBSALT002868)
- Synonyms
- Bevantolol HCl / Bevantolol hydrochloride
- External IDs
- Cl 775 / Cl-775
- UNII
- 4VB9HU07BC
- CAS Number
- 42864-78-8
- Weight
- Average: 381.9
Monoisotopic: 381.1706861 - Chemical Formula
- C20H28ClNO4
- InChI Key
- FJTKCFSPYUMXJB-UHFFFAOYSA-N
- InChI
- InChI=1S/C20H27NO4.ClH/c1-15-5-4-6-18(11-15)25-14-17(22)13-21-10-9-16-7-8-19(23-2)20(12-16)24-3;/h4-8,11-12,17,21-22H,9-10,13-14H2,1-3H3;1H
- IUPAC Name
- 1-{[2-(3,4-dimethoxyphenyl)ethyl]amino}-3-(3-methylphenoxy)propan-2-ol hydrochloride
- SMILES
- Cl.COC1=C(OC)C=C(CCNCC(O)COC2=CC=CC(C)=C2)C=C1
- External Links
- ChemSpider
- 35971
- ChEBI
- 31282
- ChEMBL
- CHEMBL2106060
- Predicted Properties
Property Value Source Water Solubility 0.0137 mg/mL ALOGPS logP 2.83 ALOGPS logP 3.03 Chemaxon logS -4.4 ALOGPS pKa (Strongest Acidic) 14.09 Chemaxon pKa (Strongest Basic) 9.31 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 2 Chemaxon Polar Surface Area 59.95 Å2 Chemaxon Rotatable Bond Count 10 Chemaxon Refractivity 98.54 m3·mol-1 Chemaxon Polarizability 39.75 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon