Home Carbonyls (3S)-3-[3-(4-Fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(4-fluorophenyl)carbonyl]piperidine

(3S)-3-[3-(4-Fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(4-fluorophenyl)carbonyl]piperidine

CAS No.:
851881-60-2
Catalog Number:
AG00G3CW
Molecular Formula:
C20H17F2N3O2
Molecular Weight:
369.3647
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1mg
≥98%
1 week
United States
$119
- +
5mg
99%
1 week
United States
$140
- +
10mg
99%
1 week
United States
$190
- +
50mg
99%
1 week
United States
$540
- +
100mg
99%
1 week
United States
$923
- +
Product Description
Catalog Number:
AG00G3CW
Chemical Name:
(3S)-3-[3-(4-Fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(4-fluorophenyl)carbonyl]piperidine
CAS Number:
851881-60-2
Molecular Formula:
C20H17F2N3O2
Molecular Weight:
369.3647
MDL Number:
MFCD17167026
IUPAC Name:
(4-fluorophenyl)-[(3S)-3-[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]methanone
InChI:
InChI=1S/C20H17F2N3O2/c21-16-7-3-13(4-8-16)18-23-19(27-24-18)15-2-1-11-25(12-15)20(26)14-5-9-17(22)10-6-14/h3-10,15H,1-2,11-12H2/t15-/m0/s1
InChI Key:
VXQCCZHCFBHTTD-HNNXBMFYSA-N
SMILES:
Fc1ccc(cc1)C(=O)N1CCC[C@@H](C1)c1onc(n1)c1ccc(cc1)F
UNII:
4C4P7L0W63
Properties
Complexity:
508  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
1  
Defined Bond Stereocenter Count:
0
Exact Mass:
369.129g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
369.372g/mol
Monoisotopic Mass:
369.129g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Literature
Title Journal
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mGlu5 Receptor Functional Interactions and Addiction. Frontiers in pharmacology 20120101
On the Role of Cannabinoid CB1- and μ-Opioid Receptors in Motor Impulsivity. Frontiers in pharmacology 20120101
Differential effect of the mGlu5 receptor positive allosteric modulator ADX-47273 on early and late hippocampal LTP. Neuropharmacology 20110901
Discovery of molecular switches within the ADX-47273 mGlu5 PAM scaffold that modulate modes of pharmacology to afford potent mGlu5 NAMs, PAMs and partial antagonists. Bioorganic & medicinal chemistry letters 20110501
Differential Modulation of Thresholds for Intracranial Self-Stimulation by mGlu5 Positive and Negative Allosteric Modulators: Implications for Effects on Drug Self-Administration. Frontiers in pharmacology 20110101
Beyond the dopamine receptor: novel therapeutic targets for treating schizophrenia. Dialogues in clinical neuroscience 20100901
Functional interaction of metabotropic glutamate receptor 5 and NMDA-receptor by a metabotropic glutamate receptor 5 positive allosteric modulator. European journal of pharmacology 20100810
Effects of a positive allosteric modulator of mGluR5 ADX47273 on conditioned avoidance response and PCP-induced hyperlocomotion in the rat as models for schizophrenia. Pharmacology, biochemistry, and behavior 20100301
Metabotropic glutamate receptors: potential drug targets for psychiatric disorders. The open medicinal chemistry journal 20100101
Effects of positive allosteric modulators on single-cell oscillatory Ca2+ signaling initiated by the type 5 metabotropic glutamate receptor. Molecular pharmacology 20091201
Comparison of the mGlu(5) receptor positive allosteric modulator ADX47273 and the mGlu(2/3) receptor agonist LY354740 in tests for antipsychotic-like activity. European journal of pharmacology 20091125
Synthesis, SAR and unanticipated pharmacological profiles of analogues of the mGluR5 ago-potentiator ADX-47273. ChemMedChem 20090401
ADX47273 [S-(4-fluoro-phenyl)-{3-[3-(4-fluoro-phenyl)-[1,2,4]-oxadiazol-5-yl]-piperidin-1-yl}-methanone]: a novel metabotropic glutamate receptor 5-selective positive allosteric modulator with preclinical antipsychotic-like and procognitive activities. The Journal of pharmacology and experimental therapeutics 20081201
Substituent effects of N-(1,3-diphenyl-1H-pyrazol-5-yl)benzamides on positive allosteric modulation of the metabotropic glutamate-5 receptor in rat cortical astrocytes. Journal of medicinal chemistry 20060601
Properties