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NPS2390

CAT: 0931-T8457-04Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T8457-04Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
226878-01-9
Target
CaSR, GluR
Related Pathways
GPCR/G Protein, Neuroscience
Purity
0.9924
Bioactivity
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)
Smiles
O=C(NC12CC3CC(CC(C3)C1)C2)c1cnc2ccccc2n1
Molecular Formula
C19H21N3O
Molecular Weight
307.39
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

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...
View on PubChemRaw 3D data
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

Alternative Products

CatalogName
GTR19166301-01NPS2390
A22631-100NPS2390 100mg
A22631-10NPS2390 10mg
A22631-5NPS2390 5mg
A22631-200NPS2390 200mg
A22631-25NPS2390 25mg
A22631-50NPS2390 50mg

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