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CAY10608

CAT: 0013-GTR19190558-03Size: 10 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19190558-03Size:10 mg
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Description
CAY10608 is a potent, selective, and non-competitive antagonist of the NMDA receptor's NR2B subunit. It demonstrates neuroprotective properties in vitro by preventing NMDA-induced neuronal damage and in vivo by reducing cerebral infarct volume in models of transient ischemia.
CAS Number
457897-92-6
Field of Research
Neuroscience, Pharmacology & Drug Discovery
Smiles
N (S (C) (=O) =O) C1=CC=C (OC[C@H] (CNCCC2=CC (Cl) =C (Cl) C=C2) O) C=C1
Molecular Formula
C18H22Cl2N2O4S
Molecular Weight
433.35
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-{4-[(2S)-3-{[2-(3,4-dichlorophenyl)ethyl]amino}-2-hydroxypropoxy]phenyl}methanesulfonamide
CAS Number457897-92-6
PubChem CID11189693
IUPAC NameN-[4-[(2S)-3-[2-(3,4-dichlorophenyl)ethylamino]-2-hydroxypropoxy]phenyl]methanesulfonamide
Molecular FormulaC18H22Cl2N2O4S
Molecular Weight433.3
XLogP3
Topological Polar Surface Area96
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Heavy Atom Count27
Formal Charge0
Complexity524
SMILES
CS(=O)(=O)NC1=CC=C(C=C1)OC[C@H](CNCCC2=CC(=C(C=C2)Cl)Cl)O
InChI
InChI=1S/C18H22Cl2N2O4S/c1-27(24,25)22-14-3-5-16(6-4-14)26-12-15(23)11-21-9-8-13-2-7-17(19)18(20)10-13/h2-7,10,15,21-23H,8-9,11-12H2,1H3/t15-/m0/s1
InChIKey
GEFDXUZHLNJUMR-HNNXBMFYSA-N
Chemical Structure
2D Structure
2D structure of N-{4-[(2S)-3-{[2-(3,4-dichlorophenyl)ethyl]amino}-2-hydroxypropoxy]phenyl}methanesulfonamide
CAS: 457897-92-6
CID: 11189693
Formula: C18H22Cl2N2O4S
MW: 433.3
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight433.3
XLogP33
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count6
Rotatable Bond Count10
Exact Mass432.0677337
Monoisotopic Mass432.0677337
Topological Polar Surface Area96 Ų
Heavy Atom Count27
Formal Charge0
Complexity524
Isotope Atom Count0
Defined Atom Stereocenter Count1
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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