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NPS2390

CAT: 1410-M21958-07Size: 200 mgDry Ice: NoHazardous: No
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CAT#:1410-M21958-07Size:200 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
NPS2390 is a first generation quinoxaline derivative that acts as a noncompetitive antagonist of mGluR1 and mGluR5 (IC50 of 5.2 and 82 nM, respectively) .
CAS Number
226878-01-9
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
307.4
Molecular Formula
C19H21N3O
Notes
Research use only, not for human use.
Receptor
MGluR

Chemical Information

Nps 2390
CAS Number226878-01-9
PubChem CID7067728
IUPAC NameN-(1-adamantyl)quinoxaline-2-carboxamide
Molecular FormulaC19H21N3O
Molecular Weight307.4
XLogP4.1
Topological Polar Surface Area54.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Heavy Atom Count23
Formal Charge0
Complexity450
SMILES
C1C2CC3CC1CC(C2)(C3)NC(=O)C4=NC5=CC=CC=C5N=C4
InChI
InChI=1S/C19H21N3O/c23-18(17-11-20-15-3-1-2-4-16(15)21-17)22-19-8-12-5-13(9-19)7-14(6-12)10-19/h1-4,11-14H,5-10H2,(H,22,23)
InChIKey
ZKFVOZCCAXQXBU-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Nps 2390
CAS: 226878-01-9
CID: 7067728
Formula: C19H21N3O
MW: 307.4
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight307.4
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count3
Rotatable Bond Count2
Exact Mass307.168462302
Monoisotopic Mass307.168462302
Topological Polar Surface Area54.9 Ų
Heavy Atom Count23
Formal Charge0
Complexity450
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