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SX-3228

CAT: 0013-GTR19204709-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19204709-02Size:50 mg
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Description
SX-3228 is a potent and selective BZ1 receptor agonist with an IC50 of 17 nM. This compound is a valuable research tool for investigating GABA-A receptor pharmacology in vitro and for studying anxiolytic or sedative mechanisms in preclinical models.
CAS Number
156364-04-4
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
C (N1CC2=C (NC (=O) C (=C2) C=3OC (OC) =NN3) CC1) C4=CC=CC=C4
Molecular Formula
C18H18N4O3
Molecular Weight
338.36
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

5,6,7,8-Tetrahydro-3-(5-methoxy-1,3,4-oxadiazol-2-yl)-6-(phenylmethyl)-1,6-naphthyridin-2(1H)-one

structure given in first source

CAS Number156364-04-4
PubChem CID133009
IUPAC Name6-benzyl-3-(5-methoxy-1,3,4-oxadiazol-2-yl)-1,5,7,8-tetrahydro-1,6-naphthyridin-2-one
Molecular FormulaC18H18N4O3
Molecular Weight338.4
XLogP0.9
Topological Polar Surface Area80.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Heavy Atom Count25
Formal Charge0
Complexity583
SMILES
COC1=NN=C(O1)C2=CC3=C(CCN(C3)CC4=CC=CC=C4)NC2=O
InChI
InChI=1S/C18H18N4O3/c1-24-18-21-20-17(25-18)14-9-13-11-22(8-7-15(13)19-16(14)23)10-12-5-3-2-4-6-12/h2-6,9H,7-8,10-11H2,1H3,(H,19,23)
InChIKey
BZLLVTYOOJNQIF-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 5,6,7,8-Tetrahydro-3-(5-methoxy-1,3,4-oxadiazol-2-yl)-6-(phenylmethyl)-1,6-naphthyridin-2(1H)-one
CAS: 156364-04-4
CID: 133009
Formula: C18H18N4O3
MW: 338.4
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight338.4
XLogP30.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count6
Rotatable Bond Count4
Exact Mass338.13789045
Monoisotopic Mass338.13789045
Topological Polar Surface Area80.5 Ų
Heavy Atom Count25
Formal Charge0
Complexity583
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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