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Radequinil

CAT: 0013-GTR19203206-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19203206-02Size:50 mg
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Description
Radequinil is a benzodiazepine receptor partial inverse agonist with high affinity for both GABA (-) and GABA (+) ligand binding sites (Kis: 5.15 and 6.11 nM) . It is a valuable research tool for investigating GABA_A receptor function in neurological studies, applicable in both in vitro binding assays and in vivo behavioral models.
CAS Number
219846-31-8
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
COc1cccc (c1) -c1nccc2[nH]c (=O) c (cc12) -c1noc (C) n1
Molecular Formula
C18H14N4O3
Molecular Weight
334.33
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5-(3-Methoxyphenyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)-2-oxo-1,2-dihydro-1,6-naphthyridine

Radequinil is a small molecule drug. The usage of the INN stem '-nil' in the name indicates that Radequinil is a benzodiazepine receptor antagonist/agonist. Radequinil is under investigation in clinical trial NCT00359944 (Safety and Efficacy Study of AC-3933 in Adults With Mild to Moderate Alzheimer's Disease). Radequinil has a monoisotopic molecular weight of 334.11 Da.

CAS Number219846-31-8
PubChem CID135418404
IUPAC Name5-(3-methoxyphenyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)-1H-1,6-naphthyridin-2-one
Molecular FormulaC18H14N4O3
Molecular Weight334.3
XLogP2.2
Topological Polar Surface Area90.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Heavy Atom Count25
Formal Charge0
Complexity540
SMILES
CC1=NC(=NO1)C2=CC3=C(C=CN=C3C4=CC(=CC=C4)OC)NC2=O
InChI
InChI=1S/C18H14N4O3/c1-10-20-17(22-25-10)14-9-13-15(21-18(14)23)6-7-19-16(13)11-4-3-5-12(8-11)24-2/h3-9H,1-2H3,(H,21,23)
InChIKey
JQOFKKWHXGQABB-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5-(3-Methoxyphenyl)-3-(5-methyl-1,2,4-oxadiazol-3-yl)-2-oxo-1,2-dihydro-1,6-naphthyridine
CAS: 219846-31-8
CID: 135418404
Formula: C18H14N4O3
MW: 334.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight334.3
XLogP32.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count3
Exact Mass334.10659032
Monoisotopic Mass334.10659032
Topological Polar Surface Area90.1 Ų
Heavy Atom Count25
Formal Charge0
Complexity540
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

Alternative Products

CatalogName
MBS387795-01Radequinil
A13395-50Radequinil 50mg
A13395-25Radequinil 25mg
A13395-10Radequinil 10mg
A13395-5Radequinil 5mg
A13395-100Radequinil 100mg
A13395-1Radequinil 1mg

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