Phenoxybenzamine hydrochlorideProduct ingredient for Phenoxybenzamine
- Name
- Phenoxybenzamine hydrochloride
- Drug Entry
- Phenoxybenzamine
An alpha-adrenergic antagonist with long duration of action. It has been used to treat hypertension and as a peripheral vasodilator.
- Accession Number
- DBSALT000480
- Structure
Structure for Phenoxybenzamine hydrochloride (DBSALT000480)
- Synonyms
- Phenoxybenzamine HCl
- UNII
- X1IEG24OHL
- CAS Number
- 63-92-3
- Weight
- Average: 340.287
Monoisotopic: 339.115669777 - Chemical Formula
- C18H23Cl2NO
- InChI Key
- VBCPVIWPDJVHAN-UHFFFAOYSA-N
- InChI
- InChI=1S/C18H22ClNO.ClH/c1-16(15-21-18-10-6-3-7-11-18)20(13-12-19)14-17-8-4-2-5-9-17;/h2-11,16H,12-15H2,1H3;1H
- IUPAC Name
- benzyl(2-chloroethyl)(1-phenoxypropan-2-yl)amine hydrochloride
- SMILES
- Cl.CC(COC1=CC=CC=C1)N(CCCl)CC1=CC=CC=C1
- External Links
- KEGG Compound
- C07436
- PubChem Compound
- 6141
- ChemSpider
- 5911
- ChEBI
- 8078
- ChEMBL
- CHEMBL1200787
- Wikipedia
- Phenoxybenzamine
- Predicted Properties
Property Value Source Water Solubility 0.0103 mg/mL ALOGPS logP 4.26 ALOGPS logP 4.64 Chemaxon logS -4.5 ALOGPS pKa (Strongest Basic) 7.89 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 2 Chemaxon Hydrogen Donor Count 0 Chemaxon Polar Surface Area 12.47 Å2 Chemaxon Rotatable Bond Count 8 Chemaxon Refractivity 88.92 m3·mol-1 Chemaxon Polarizability 34.08 Å3 Chemaxon Number of Rings 2 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon