Products for Research Use Only

AZD 9272

CAT: 1410-M14063-07Size: 100 mgDry Ice: NoHazardous: No
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CAT#:1410-M14063-07Size:100 mg
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24/48H Stock Items & 2 to 6 Weeks non Stock Items.
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Description
A potent, selective, highly CNS-penetrant and orally available mGluR5 negative allosteric modulator Kd of 2.8 nM.
CAS Number
327056-26-8
Stability
≥ 2 years
Purity
>98% (HPLC)
Weight
284.226
Molecular Formula
C14H6F2N4O
Notes
Research use only, not for human use.
Receptor
MGluR

Chemical Information

Azd-9272

an mGluR5 antagonist

CAS Number327056-26-8
PubChem CID9838729
IUPAC Name3-fluoro-5-[3-(5-fluoro-2-pyridinyl)-1,2,4-oxadiazol-5-yl]benzonitrile
Molecular FormulaC14H6F2N4O
Molecular Weight284.22
XLogP2.3
Topological Polar Surface Area75.6
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Heavy Atom Count21
Formal Charge0
Complexity415
SMILES
C1=CC(=NC=C1F)C2=NOC(=N2)C3=CC(=CC(=C3)C#N)F
InChI
InChI=1S/C14H6F2N4O/c15-10-1-2-12(18-7-10)13-19-14(21-20-13)9-3-8(6-17)4-11(16)5-9/h1-5,7H
InChIKey
RBSPCALDSNXWEP-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Azd-9272
CAS: 327056-26-8
CID: 9838729
Formula: C14H6F2N4O
MW: 284.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight284.22
XLogP32.3
Hydrogen Bond Donor Count0
Hydrogen Bond Acceptor Count7
Rotatable Bond Count2
Exact Mass284.05096715
Monoisotopic Mass284.05096715
Topological Polar Surface Area75.6 Ų
Heavy Atom Count21
Formal Charge0
Complexity415
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