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Imoxiterol

CAT: 0804-HY-101585Size: 1 mgDry Ice: NoHazardous: No
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CAT#:0804-HY-101585Size:1 mg
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Description
Imoxiterol (RP 58802B) is a β-adrenergic agonist.
CAS Number
88578-07-8
Product Name Alternative
RP 58802B
UNSPSC
12352005
Target
Adrenergic Receptor
Type
Reference compound
Related Pathways
GPCR/G Protein; Neuronal Signaling
Applications
Neuroscience-Neuromodulation
Field of Research
Neurological Disease; Endocrinology
Assay Protocol
https://www.medchemexpress.com/Imoxiterol.html
Purity
98.0
Solubility
10 mM in DMSO
Smiles
OC(CNC(C)CCN1C2=CC=CC=C2N=C1)C3=CC=C(O)C(OC)=C3
Molecular Formula
C20H25N3O3
Molecular Weight
355.43
Shipping Conditions
Room Temperature
Storage Conditions
-20°C, 3 years; 4°C, 2 years (Powder)
Scientific Category
Reference compound1
Clinical Information
No Development Reported
Isoform
β adrenergic receptor

Chemical Information

Imoxiterol
CAS Number88578-07-8
PubChem CID65665
IUPAC Name4-[2-[4-(benzimidazol-1-yl)butan-2-ylamino]-1-hydroxyethyl]-2-methoxyphenol
Molecular FormulaC20H25N3O3
Molecular Weight355.4
XLogP2.2
Topological Polar Surface Area79.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Heavy Atom Count26
Formal Charge0
Complexity425
SMILES
CC(CCN1C=NC2=CC=CC=C21)NCC(C3=CC(=C(C=C3)O)OC)O
InChI
InChI=1S/C20H25N3O3/c1-14(9-10-23-13-22-16-5-3-4-6-17(16)23)21-12-19(25)15-7-8-18(24)20(11-15)26-2/h3-8,11,13-14,19,21,24-25H,9-10,12H2,1-2H3
InChIKey
NKKPVWPMPWLEMY-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Imoxiterol
CAS: 88578-07-8
CID: 65665
Formula: C20H25N3O3
MW: 355.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight355.4
XLogP32.2
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count5
Rotatable Bond Count8
Exact Mass355.18959167
Monoisotopic Mass355.18959167
Topological Polar Surface Area79.5 Ų
Heavy Atom Count26
Formal Charge0
Complexity425
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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