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Bevantolol

CAT: 0931-T61138-03Size: 100 mgDry Ice: NoHazardous: No
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CAT#:0931-T61138-03Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
59170-23-9
Target
Others, Adrenergic Receptor
Related Pathways
GPCR/G Protein, Others, Neuroscience
Bioactivity
Bevantolol, a selective β-1 adrenoceptor antagonist, is utilized for the investigation of angina pectoris and hypertension [1].
Smiles
O(C)C1=C(OC)C=C(CCNCC(COC2=CC(C)=CC=C2)O)C=C1
Molecular Formula
C20H27NO4
Molecular Weight
345.43
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

Bevantolol

Bevantolol is a propanolamine that is 3-aminopropane-1,2-diol in which the hydrogen of the primary hydroxy group is substituted by 3-methylphenyl and one of the hydrogens attached to the nitrogen is substituted by 2-(3,4-dimethoxyphenyl)ethyl. A beta1 adrenoceptor antagonist, it has been shown to be as effective as other beta-blockers for the treatment of angina pectoris and hypertension. It has a role as a beta-adrenergic antagonist, an antihypertensive agent, an anti-arrhythmia drug and a calcium channel blocker.

CAS Number59170-23-9
PubChem CID2372
IUPAC Name1-[2-(3,4-dimethoxyphenyl)ethylamino]-3-(3-methylphenoxy)propan-2-ol
Molecular FormulaC20H27NO4
Molecular Weight345.4
XLogP3
Topological Polar Surface Area60
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Heavy Atom Count25
Formal Charge0
Complexity355
SMILES
CC1=CC(=CC=C1)OCC(CNCCC2=CC(=C(C=C2)OC)OC)O
InChI
InChI=1S/C20H27NO4/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
InChIKey
HXLAFSUPPDYFEO-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Bevantolol
CAS: 59170-23-9
CID: 2372
Formula: C20H27NO4
MW: 345.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight345.4
XLogP33
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count10
Exact Mass345.19400834
Monoisotopic Mass345.19400834
Topological Polar Surface Area60 Ų
Heavy Atom Count25
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 Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
HY-A0249Bevantolol
HY-121186-01Bevantolol (hydrochloride)
TRC-B334500-10MGBevantolol Hydrochloride
264123-01Bevantolol HCl
RM-B632008-01Bevantolol Impurity 8
RM-B632001-01Bevantolol Impurity 1
RM-B632012-01Bevantolol Impurity 12
RM-B632010-01Bevantolol Impurity 10

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