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VU0410425

CAT: 0013-GTR19200157-02Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0013-GTR19200157-02Size:50 mg
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Description
VU0410425 is a selective negative allosteric modulator (NAM) of the metabotropic glutamate receptor 1 (mGluR1) . It is a valuable research tool for investigating mGluR1 function in neurological disorders, utilized in both in vitro assays and in vivo rodent models of conditions like Parkinson's disease and neuropathic pain.
CAS Number
1341167-72-3
Field of Research
Neuroscience
Smiles
CC1 (C) C2C1C (=O) N (C2=O) C3=C (Cl) C=C (NC (=O) C4=CC=CC=N4) C=C3
Molecular Formula
C19H16ClN3O3
Molecular Weight
369.8
Storage Conditions
-20°C
Notes
For research use only.

Chemical Information

N-[3-chloro-4-(6,6-dimethyl-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl)phenyl]pyridine-2-carboxamide
CAS Number1341167-72-3
PubChem CID75238115
IUPAC NameN-[3-chloro-4-(6,6-dimethyl-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl)phenyl]pyridine-2-carboxamide
Molecular FormulaC19H16ClN3O3
Molecular Weight369.8
XLogP2.5
Topological Polar Surface Area79.4
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Heavy Atom Count26
Formal Charge0
Complexity614
SMILES
CC1(C2C1C(=O)N(C2=O)C3=C(C=C(C=C3)NC(=O)C4=CC=CC=N4)Cl)C
InChI
InChI=1S/C19H16ClN3O3/c1-19(2)14-15(19)18(26)23(17(14)25)13-7-6-10(9-11(13)20)22-16(24)12-5-3-4-8-21-12/h3-9,14-15H,1-2H3,(H,22,24)
InChIKey
CEQFGBDWPIJQAJ-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of N-[3-chloro-4-(6,6-dimethyl-2,4-dioxo-3-azabicyclo[3.1.0]hexan-3-yl)phenyl]pyridine-2-carboxamide
CAS: 1341167-72-3
CID: 75238115
Formula: C19H16ClN3O3
MW: 369.8
Interactive 3D Structure
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View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight369.8
XLogP32.5
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count3
Exact Mass369.0880191
Monoisotopic Mass369.0880191
Topological Polar Surface Area79.4 Ų
Heavy Atom Count26
Formal Charge0
Complexity614
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count2
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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