ABT-418 hydrochloride

Base Information

Chemical Name:ABT-418 hydrochloride
CAS No.:147388-83-8
Molecular Formula:C₉H₁₄N₂O*ClH
Molecular Weight:202.684
Hs Code.:
European Community (EC) Number:685-692-8
UNII:1ALA933VO4
DSSTox Substance ID:DTXSID60438901
Mol file:147388-83-8.mol

Synonyms:ABT-418 hydrochloride;147388-83-8;ABT-418 (hydrochloride);ABT 418 hydrochloride;3-Methyl-5-[(2S)-1-methyl-2-pyrrolidinyl]isoxazole hydrochloride;1ALA933VO4;UNII-1ALA933VO4;3-methyl-5-(1-methyl-2(s)-pyrrolidinyl)isoxazole hydrochloride;3-Methyl-5-(1-methyl-2(S)-pyrrolidinyl)isoxazole hydrochloride(monohcl);3-methyl-5-[(2S)-1-methylpyrrolidin-2-yl]-1,2-oxazole;hydrochloride;Isoxazole, 3-methyl-5-(1-methyl-2-pyrrolidinyl)-, monohydrochloride, (S)-;MFCD11045960;ABT-418 HCl;SCHEMBL7130413;DTXSID60438901;Tox21_500151;CCG-221455;HY-105170B;LP00151;NCGC00260836-01;MS-23097;CS-0025191;ABT-418 hydrochloride, powder, >=98% (HPLC);J-008352;(S)-3-Methyl-5-(1-methylpyrrolidin-2-yl)-isoxazole HCl;(S)-3-Methyl-5-(1-methylpyrrolidin-2-yl)-isoxazole-HCl;(s)-3-methyl-5-(1-methyl-2-pyrrolidinyl) isox-azole hydrochloride

Suppliers and Price of ABT-418 hydrochloride

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
ABT-418 hydrochloride
5mg
$ 165.00

TRC
ABT-418 hydrochloride
10mg
$ 265.00

Sigma-Aldrich
ABT-418 hydrochloride powder, ≥98% (HPLC)
5mg
$ 237.00

Sigma-Aldrich
ABT-418 hydrochloride powder, ≥98% (HPLC)
25mg
$ 813.00

ChemScene
ABT-418 hydrochloride 99.53%
100mg
$ 850.00

ChemScene
ABT-418 hydrochloride 99.53%
5mg
$ 120.00

ChemScene
ABT-418 hydrochloride 99.53%
50mg
$ 600.00

ChemScene
ABT-418 hydrochloride 99.53%
25mg
$ 400.00

ChemScene
ABT-418 hydrochloride 99.53%
10mg
$ 200.00

Biorbyt Ltd
AbT-418 HCl >98%
25 mg
$ 654.50

Total 8 raw suppliers

Chemical Property of ABT-418 hydrochloride

Chemical Property:

Vapor Pressure:0.0232mmHg at 25°C
Boiling Point:249.2°C at 760 mmHg
Flash Point:104.5°C
PSA：29.27000
LogP:2.48960
Storage Temp.:-20°C
Solubility.:H2O: 15 mg/mL, soluble
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:202.0872908
Heavy Atom Count:13
Complexity:163

Purity/Quality:

97% ^*data from raw suppliers

ABT-418 hydrochloride ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:T+
Statements: 26/27/28
Safety Statements: 22-28-36/37-45-7/9

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=NOC(=C1)C2CCCN2C.Cl
Isomeric SMILES:CC1=NOC(=C1)[C@@H]2CCCN2C.Cl
Description ABT-418 (CAS 147388-83-8) is an agonist at neuronal nicotinic acetylcholine receptors displaying the highest potency at α4β2 and α2β2 subtypes (EC50= approximately 6 and 11 μM, respectively).1 Displays anxiolytic activity in a rat model and was 6-fold more potent than diazepam.2 Reduces distractibility in a primate model3 and may have relevance in attention deficit hyperactivity disorder4. Improves cognition in Alzheimer’s disease patients.5
Uses ABT-418 Hydrochloride is a neuronal nicotinic acetylcholine receptor agonist or activator which can be synthesized from L-proline.

Technology Process of ABT-418 hydrochloride

There total 2 articles about ABT-418 hydrochloride which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 86.0%