Tebanicline hydrochloride

Base Information

• Chemical Name: Tebanicline hydrochloride
• CAS No.: 203564-54-9
• Molecular Formula: C9H12Cl2N2O
• Molecular Weight: 235.11
• UNII: 48U2WUT775
• Wikidata: Q27259178
• Mol file: 203564-54-9.mol

Synonyms:Tebanicline hydrochloride;203564-54-9;Tebanicline HCl;ABT-594 hydrochloride;Tebanicline (hydrochloride);Pyridine, 5-[(2R)-2-azetidinylmethoxy]-2-chloro-, monohydrochloride;UNII-48U2WUT775;48U2WUT775;5-((2R)-2-Azetidinylmethoxy)-2-chloropyridine, hydrochloride;Pyridine, 5-((2R)-2-azetidinylmethoxy)-2-chloro-, hydrochloride (1:1);203564-54-9 (HCl);5-[[(2R)-azetidin-2-yl]methoxy]-2-chloropyridine hydrochloride;Ebanicline hydrochloride;ABT 594 hydrochloride;Tebanicline(hydrochloride);SCHEMBL15663029;BCP25177;TEBANICLINE HYDROCHLORIDE [MI];AKOS040755674;AS-78934;P18225;Q27259178;(R)-5-(Azetidin-2-ylmethoxy)-2-chloropyridine hydrochloride;5-[[(2R)-AZETIDIN-2-YL]METHOXY]-2-CHLORO-PYRIDINE HCL;5-[[(2R)-azetidin-2-yl]methoxy]-2-chloropyridine;hydrochloride

Chemical Property of Tebanicline hydrochloride

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 234.0326684
• Heavy Atom Count: 14
• Complexity: 168

Purity/Quality:

99%, ^*data from raw suppliers

ABT594Hydrochloride ^*data from reagent suppliers

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: C1CNC1COC2=CN=C(C=C2)Cl.Cl
• Isomeric SMILES: C1CN[C@H]1COC2=CN=C(C=C2)Cl.Cl
• Description: ABT-594 is a potent agonist of neuronal α4β2 subunit-containing nicotinic acetylcholine receptors (nAChRs; Ki = 37 pM in a radioligand binding assay). It is selective for neuronal nAChRs over neuromuscular α1β1δγ subunit-containing nAChRs (Ki = 10,000 nM), α1B-, α2B-, and α2C- adrenergic receptors (Kis = 890, 597, and 342 nM, respectively), and 70 other receptors, enzymes, and transporters (Kis = >1,000 nM) in radioligand binding assays. ABT-594 induces [86Rb+] efflux in K177 cells transfected with human neuronal α4β2 subunit-containing nAChRs (EC50 = 140 nM). In vivo, ABT-594 (0.05 and 0.01 mg/kg, s.c.) increases latency to paw withdrawal in a hot-plate test in rats. It also induces hypothermia, seizures, and an increase in blood pressure.
• Uses: ABT 594 Hydrochloride selective α4β2 nAChR agonist (EC50 = 140 nM for human α4β2 nAChRs, in vitro). Exhibits >900-fold selectivity for α4β2 nAChRs over other neurotransmitter receptors. Displays analgesic properties in various animal models of pain. Potentiates gabapentin mediated analgesia. Also demonstrates cognitive enhancement effects in rodent model of attention deficit.

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