Products for Research Use Only

Phenoprolamine Hydrochloride

CAT: 0013-GTR19196732-01Size: 25 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19196732-01Size:25 mg
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Description
Phenoprolamine Hydrochloride is a selective α1-adrenergic receptor antagonist with antihypertensive, neuroprotective, and cardioprotective properties. It inhibits CYP2D and CYP3A enzymes and readily crosses the blood-brain barrier to relax cerebral vascular smooth muscle, making it a useful research tool for cardiovascular and cerebrovascular studies in vitro and in vivo.
CAS Number
93933-71-2
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
Cl.O (C1=CC=C (C=C1OC) CCNC (C) COC=2C (=CC=CC2C) C) C
Molecular Formula
C21H30ClNO3
Molecular Weight
379.92
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Phenoprolamine Hydrochloride

structure in first source

CAS Number93933-71-2
PubChem CID10068314
IUPAC NameN-[2-(3,4-dimethoxyphenyl)ethyl]-1-(2,6-dimethylphenoxy)propan-2-amine;hydrochloride
Molecular FormulaC21H30ClNO3
Molecular Weight379.9
Topological Polar Surface Area39.7
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Heavy Atom Count26
Formal Charge0
Complexity355
SMILES
CC1=C(C(=CC=C1)C)OCC(C)NCCC2=CC(=C(C=C2)OC)OC.Cl
InChI
InChI=1S/C21H29NO3.ClH/c1-15-7-6-8-16(2)21(15)25-14-17(3)22-12-11-18-9-10-19(23-4)20(13-18)24-5;/h6-10,13,17,22H,11-12,14H2,1-5H3;1H
InChIKey
KNMNNEPMKDJBDW-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Phenoprolamine Hydrochloride
CAS: 93933-71-2
CID: 10068314
Formula: C21H30ClNO3
MW: 379.9
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight379.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count4
Rotatable Bond Count9
Exact Mass379.1914215
Monoisotopic Mass379.1914215
Topological Polar Surface Area39.7 Ų
Heavy Atom Count26
Formal Charge0
Complexity355
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count1
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes