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Arbutamine

CAT: 1410-M32786-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:1410-M32786-02Size:5 mg
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Description
Arbutamine (GP 21213) is a novel potent non-selective beta-adrenoceptor agonist with alpha-1-sympathomimetic activity.Arbutamine promotes cardiac stress and increases heart rate, cardiac contractility.Arbutamine can be used to study cardiac stress and coronary artery disease
CAS Number
128470-16-6
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
317.38
Molecular Formula
C18H23NO4
Notes
Research use only, not for human use.
Receptor
Adrenergic Receptor

Chemical Information

Arbutamine

Arbutamine is a catecholamine. It has a role as a beta-adrenergic agonist and a cardiotonic drug.

CAS Number128470-16-6
PubChem CID60789
IUPAC Name4-[(1R)-1-hydroxy-2-[4-(4-hydroxyphenyl)butylamino]ethyl]benzene-1,2-diol
Molecular FormulaC18H23NO4
Molecular Weight317.4
XLogP0.9
Topological Polar Surface Area93
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count23
Formal Charge0
Complexity320
SMILES
C1=CC(=CC=C1CCCCNC[C@@H](C2=CC(=C(C=C2)O)O)O)O
InChI
InChI=1S/C18H23NO4/c20-15-7-4-13(5-8-15)3-1-2-10-19-12-18(23)14-6-9-16(21)17(22)11-14/h4-9,11,18-23H,1-3,10,12H2/t18-/m0/s1
InChIKey
IIRWWTKISYTTBL-SFHVURJKSA-N
Chemical Structure
2D Structure
2D structure of Arbutamine
CAS: 128470-16-6
CID: 60789
Formula: C18H23NO4
MW: 317.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight317.4
XLogP30.9
Hydrogen Bond Donor Count5
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass317.16270821
Monoisotopic Mass317.16270821
Topological Polar Surface Area93 Ų
Heavy Atom Count23
Formal Charge0
Complexity320
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes