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NP10679

CAT: 0013-GTR19212100-02Size: 5 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19212100-02Size:5 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
NP10679 is a potent, brain-penetrant, and pH-sensitive GluN2B-selective NMDA receptor antagonist with oral bioavailability. Its off-target activity includes inhibition of histamine H1 and hERG. This profile makes it a useful research tool for investigating mechanisms in epilepsy and ischemic stroke models, both in vitro and in vivo.
CAS Number
2914889-88-4
Product Name Alternative
NMDA receptor, Histamine Receptor, HistamineReceptor, hERG, CYP
Field of Research
Immunology & Inflammation, Metabolism Research, Neuroscience, Pharmacology & Drug Discovery
Purity
99.43% (May vary between batches)
Solubility
DMSO:80 mg/mL (177.99 mM)
Smiles
O (C[C@@H] (CN1CCN (CC1) C2=CC=C (C (F) (F) F) C=C2) O) C=3C=C4C (=CC3) NC (=O) CC4
Molecular Formula
C23H26F3N3O3
Molecular Weight
449.47
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

Np-10679
CAS Number2914889-88-4
PubChem CID162623707
IUPAC Name6-[(2R)-2-hydroxy-3-[4-[4-(trifluoromethyl)phenyl]piperazin-1-yl]propoxy]-3,4-dihydro-1H-quinolin-2-one
Molecular FormulaC23H26F3N3O3
Molecular Weight449.5
XLogP2.9
Topological Polar Surface Area65
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Heavy Atom Count32
Formal Charge0
Complexity619
SMILES
C1CC(=O)NC2=C1C=C(C=C2)OC[C@@H](CN3CCN(CC3)C4=CC=C(C=C4)C(F)(F)F)O
InChI
InChI=1S/C23H26F3N3O3/c24-23(25,26)17-2-4-18(5-3-17)29-11-9-28(10-12-29)14-19(30)15-32-20-6-7-21-16(13-20)1-8-22(31)27-21/h2-7,13,19,30H,1,8-12,14-15H2,(H,27,31)/t19-/m1/s1
InChIKey
QJKYLYXHWSCZQT-LJQANCHMSA-N
Chemical Structure
2D Structure
2D structure of Np-10679
CAS: 2914889-88-4
CID: 162623707
Formula: C23H26F3N3O3
MW: 449.5
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight449.5
XLogP32.9
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count6
Exact Mass449.19262619
Monoisotopic Mass449.19262619
Topological Polar Surface Area65 Ų
Heavy Atom Count32
Formal Charge0
Complexity619
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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