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Tebanicline

CAT: 1410-M17413-04Size: 10 mgDry Ice: NoHazardous: No
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CAT#:1410-M17413-04Size:10 mg
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Description
Tebanicline (ABT-594, Ebanicline) acts as a partial agonist at neuronal nicotinic acetylcholine receptors, binding to both the α3β4 and the α4β2 subtypes.
CAS Number
198283-73-7
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
198.65
Molecular Formula
C9H11ClN2O
Notes
Research use only, not for human use.
Receptor
NAChR

Chemical Information

Tebanicline

Tebanicline is a monochloropyridine that is 2-chloropyridine substituted by a (2R)-azetidin-2-ylmethoxy group at position 5. It is a potent nicotinic acetylcholine receptor agonist with analgesic and antinociceptive properties. It has a role as an antinociceptive agent, a non-narcotic analgesic and a nicotinic acetylcholine receptor agonist. It is an aromatic ether, a member of azetidines and a monochloropyridine.

CAS Number198283-73-7
PubChem CID3075702
IUPAC Name5-[[(2R)-azetidin-2-yl]methoxy]-2-chloropyridine
Molecular FormulaC9H11ClN2O
Molecular Weight198.65
XLogP1.6
Topological Polar Surface Area34.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Heavy Atom Count13
Formal Charge0
Complexity168
SMILES
C1CN[C@H]1COC2=CN=C(C=C2)Cl
InChI
InChI=1S/C9H11ClN2O/c10-9-2-1-8(5-12-9)13-6-7-3-4-11-7/h1-2,5,7,11H,3-4,6H2/t7-/m1/s1
InChIKey
MKTAGSRKQIGEBH-SSDOTTSWSA-N
Chemical Structure
2D Structure
2D structure of Tebanicline
CAS: 198283-73-7
CID: 3075702
Formula: C9H11ClN2O
MW: 198.65
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight198.65
XLogP31.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count3
Exact Mass198.0559907
Monoisotopic Mass198.0559907
Topological Polar Surface Area34.2 Ų
Heavy Atom Count13
Formal Charge0
Complexity168
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

Alternative Products

CatalogName
MBS131568Tebanicline
HY-14316A-01Tebanicline (dihydrochloride)
T3720-01Tebanicline hydrochloride
T3694L-01Tebanicline tosylate
JH918344Tebanicline (hydrochloride)
HY-14316C-01Tebanicline (tosylate)
526423Tebanicline HCl
T60474-01Tebanicline dihydrochloride
A21918-100Tebanicline hydrochloride 100mg
A21918-500Tebanicline hydrochloride 500mg

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