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GYKI-47261

CAT: 0804-HY-19435Size: 1 EachDry Ice: NoHazardous: No
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CAT#:0804-HY-19435Size:1 Each
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Description
GYKI-47261 is a competitive, orally active, and selective AMPA receptor antagonist with an IC50 of 2.5 μM. GYKI-47261 has broad spectrum anticonvulsive activity and neuroprotective effects. GYKI-47261 is also a potent inducer of CYP2E1[1][2].
CAS Number
220445-20-5
UNSPSC
12352005
Target
Cytochrome P450; iGluR
Type
Reference compound
Related Pathways
Membrane Transporter/Ion Channel; Metabolic Enzyme/Protease; Neuronal Signaling
Field of Research
Neurological Disease
Assay Protocol
https://www.medchemexpress.com/gyki-47261.html
Smiles
NC1=CC=C(C2=NN3C(CC4=CC=C(Cl)C=C42)=NC(C)=C3)C=C1
Molecular Formula
C18H15ClN4
Molecular Weight
322.79
References & Citations
[1]Abrahám G, et al. New non competitive AMPA antagonists. Bioorg Med Chem. 2000;8 (8) :2127-2143.|[2]Tamási V, et al. GYKI-47261, a new AMPA [2-amino-3- (3-hydroxymethylisoxazole-4-yl) propionic acid] antagonist, is a CYP2E1 inducer. Drug Metab Dispos. 2003;31 (11) :1310-1314.
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Gyki-47261

structure in first source

CAS Number220445-20-5
PubChem CID9927197
IUPAC Name4-(8-chloro-2-methyl-11H-imidazo[1,2-c][2,3]benzodiazepin-6-yl)aniline
Molecular FormulaC18H15ClN4
Molecular Weight322.8
XLogP3.9
Topological Polar Surface Area56.2
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Heavy Atom Count23
Formal Charge0
Complexity460
SMILES
CC1=CN2C(=N1)CC3=C(C=C(C=C3)Cl)C(=N2)C4=CC=C(C=C4)N
InChI
InChI=1S/C18H15ClN4/c1-11-10-23-17(21-11)8-13-2-5-14(19)9-16(13)18(22-23)12-3-6-15(20)7-4-12/h2-7,9-10H,8,20H2,1H3
InChIKey
FPXVCCSOTAQPIV-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Gyki-47261
CAS: 220445-20-5
CID: 9927197
Formula: C18H15ClN4
MW: 322.8
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight322.8
XLogP33.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count1
Exact Mass322.0985242
Monoisotopic Mass322.0985242
Topological Polar Surface Area56.2 Ų
Heavy Atom Count23
Formal Charge0
Complexity460
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

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