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VU0422288

CAT: 0931-T29135-04Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0931-T29135-04Size:50 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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CAS Number
1630936-95-6
Target
GluR
Related Pathways
Neuroscience
Purity
0.9977
Bioactivity
VU0422288 (ML396) is a potent orthosteric modulator of type III mGlu receptors (mGlus) .VU0422288 shows inhibition of mGluR4, mGluR7, and mGluR8 in a calcium mobilization assay.VU0422288 can be used to study Rett syndrome (RTT) .
Smiles
Clc1ccc(Oc2ccc(NC(=O)c3ccccn3)cc2Cl)nc1
Molecular Formula
C17H11Cl2N3O2
Molecular Weight
360.19
Shipping Conditions
Ice Packs
Storage Temperature
-20°C

Chemical Information

VU0422288

a positive allosteric modulator of metabotropic glutamate receptor 7; structure in first source

CAS Number1630936-95-6
PubChem CID73058507
IUPAC NameN-[3-chloro-4-[(5-chloro-2-pyridinyl)oxy]phenyl]pyridine-2-carboxamide
Molecular FormulaC17H11Cl2N3O2
Molecular Weight360.2
XLogP4.1
Topological Polar Surface Area64.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Heavy Atom Count24
Formal Charge0
Complexity427
SMILES
C1=CC=NC(=C1)C(=O)NC2=CC(=C(C=C2)OC3=NC=C(C=C3)Cl)Cl
InChI
InChI=1S/C17H11Cl2N3O2/c18-11-4-7-16(21-10-11)24-15-6-5-12(9-13(15)19)22-17(23)14-3-1-2-8-20-14/h1-10H,(H,22,23)
InChIKey
MZRLPXFGQKQHST-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of VU0422288
CAS: 1630936-95-6
CID: 73058507
Formula: C17H11Cl2N3O2
MW: 360.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight360.2
XLogP34.1
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count4
Exact Mass359.0228320
Monoisotopic Mass359.0228320
Topological Polar Surface Area64.1 Ų
Heavy Atom Count24
Formal Charge0
Complexity427
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
BA5566-10VU0422288

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