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934282-55-0

934282-55-0 Structure

934282-55-0 Structure
IdentificationBack Directory
[Name]

(R)-5-(3-chlorophenyl)-3-(1-((4-Methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)oxy)ethyl)isoxazole
[CAS]

934282-55-0
[Synonyms]

AZD2066)
AZD 2066 (AZD-2066
4-[5-[(1R)-1-[5-(3-Chlorophenyl)-3-isoxazolyl]ethoxy]-4-methyl-4H-1,2,4-triazol-3-yl]pyridine
Pyridine, 4-[5-[(1R)-1-[5-(3-chlorophenyl)-3-isoxazolyl]ethoxy]-4-methyl-4H-1,2,4-triazol-3-yl]-
(R)-5-(3-chlorophenyl)-3-(1-((4-Methyl-5-(pyridin-4-yl)-4H-1,2,4-triazol-3-yl)oxy)ethyl)isoxazole
[Molecular Formula]

C19H16ClN5O2
[MDL Number]

MFCD22420281
[MOL File]

934282-55-0.mol
[Molecular Weight]

381.82
Chemical PropertiesBack Directory
[Melting point ]

140-142°C
[Boiling point ]

626.3±65.0 °C(Predicted)
[density ]

1.39±0.1 g/cm3(Predicted)
[storage temp. ]

-20°C Freezer, Under inert atmosphere
[solubility ]

Chloroform (Slightly), DMSO (Slightly), Methanol (Slightly)
[form ]

Solid
[pka]

1.91±0.10(Predicted)
[color ]

White to Off-White
[InChI]

1S/C19H16ClN5O2/c1-12(16-11-17(27-24-16)14-4-3-5-15(20)10-14)26-19-23-22-18(25(19)2)13-6-8-21-9-7-13/h3-12H,1-2H3/t12-/m1/s1
[InChIKey]

SXWHYTICXCLKDG-GFCCVEGCSA-N
[SMILES]

Clc1cc(ccc1)c2[o]nc(c2)[C@H](Oc3[n](c(nn3)c4ccncc4)C)C
Safety DataBack Directory
[Symbol(GHS) ]


GHS08,GHS07
[Signal word ]

Warning
[Hazard statements ]

H361-H302
[Precautionary statements ]

P201-P202-P281-P308+P313-P405-P501-P264-P270-P301+P312-P330-P501
[WGK Germany ]

WGK 3
[Storage Class]

11 - Combustible Solids
Hazard InformationBack Directory
[Uses]

AZD 2066 is a mGluR5 anatagonist that is used for treating and preventing pain, neurological, psychiatric and other diseases.
[Biological Activity]

AZD2066 is an orally bioavailablebrain penetrantselective and potent negative allosteric modulator of the metabotropic glutamate receptor subtype 5 (mGlu5). AZD2066 exhibited satisfactory efficacy in patients suffering from neuropathic pain with mechanical hypersensitivity.
[in vivo]

AZD 2066 (0.3-30 mg/kg, p.o., 60 min) shows discriminative effects in rats[2].
AZD-2066 (10 μM, perfusion of brain slide) alleviates dihydroxyphenylglycine (DHPG)-facilitated long-term depression (LTD) expression in chronic social defeat stress (CSDS)-treated mice via BDNF/trkB signaling pathway[5].
AZD-2066 (5 mg/kg, i.p., 2 × 12 h) alleviates chronic social defeat stress (CSDS)-induced depressive behaviors in mice[5].

Animal Model:Male Wistar rats (weighing 240-250 g)[2]
Dosage:0.03, 0.1, 0.3, 1, 3, 10, 30 mg/kg
Administration:Oral gavage (p.o.)
Result:Caused full and dose-dependent AZD9272-appropriate responding.
Animal Model:Depressive model (C57BL/6 mice were subjected to physical defeats that were generated by a CD-1 aggressor for 5 min every day for 10 days)[5]
Dosage:5 mg/kg
Administration:Intraperitoneal injection (i.p.), 2 × 12 h
Result:Increased social interaction ratio.
Reversed time spent in interaction zone.
Increased sucrose preference scores.
[IC 50]

mGluR5
[storage]

Store at -20°C
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