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245728-44-3

245728-44-3 Structure

245728-44-3 Structure
IdentificationBack Directory
[Name]

1H-Pyridazino[4,5-e][1,3,4]thiadiazin-5(6H)-one, 3-[[(2,4-dichlorophenyl)methyl]thio]-1,6-dimethyl-
[CAS]

245728-44-3
[Synonyms]

BTB09089
GPR65 agonist (BTB09089)
1H-Pyridazino[4,5-e][1,3,4]thiadiazin-5(6H)-one, 3-[[(2,4-dichlorophenyl)methyl]thio]-1,6-dimethyl-
[Molecular Formula]

C14H12Cl2N4OS2
[MOL File]

245728-44-3.mol
[Molecular Weight]

387.31
Chemical PropertiesBack Directory
[Boiling point ]

500.6±60.0 °C(Predicted)
[density ]

1.57±0.1 g/cm3(Predicted)
[form ]

Solid
[pka]

-0.51±0.40(Predicted)
[color ]

Yellow to orange
[InChI]

InChI=1S/C14H12Cl2N4OS2/c1-19-11-6-17-20(2)13(21)12(11)23-14(18-19)22-7-8-3-4-9(15)5-10(8)16/h3-6H,7H2,1-2H3
[InChIKey]

PIAWQVCBQLTEIY-UHFFFAOYSA-N
[SMILES]

S1C2C(=O)N(C)N=CC=2N(C)N=C1SCC1=CC=C(Cl)C=C1Cl
Hazard InformationBack Directory
[Uses]

BTB09089 is a T cell death-associated gene 8 (TDAG8/GPR65) specific agonist. BTB09089 increases TDAG8 expression and regulates the cytokine production of T cells and macrophages[1].
[in vivo]

BTB09089 (5-20 μM, 8 μL; i.c.v.; 6 hours prior to MCAO) reduces cerebral ischaemia-reperfusion injury in rats[2].

Animal Model:Adult male SD rats (270-280 g), middle cerebral artery occlusion (MCAO) model[2]
Dosage:5, 10 and 20 μM, 8 μL
Administration:Intracerebroventricular injection, six hours prior to MCAO
Result:Up-regulated TDAG8 and Bcl-2 expression and down-regulated cleaved caspase-3 expression, while the infarction volume was reduced, and neurological deficits were ameliorated 24 and 72 h after MCAO.
[References]

[1] Onozawa Y, et al. Activation of T cell death-associated gene 8 regulates the cytokine production of T cells and macrophages in vitro. Eur J Pharmacol. 2012 May 15;683(1-3):325-31. DOI:10.1016/j.ejphar.2012.03.007
[2] Ma XD, et al. TDAG8 activation attenuates cerebral ischaemia-reperfusion injury via Akt signalling in rats. Exp Neurol. 2017 Jul;293:115-123. DOI:10.1016/j.expneurol.2017.03.023
Spectrum DetailBack Directory
[Spectrum Detail]

1H-Pyridazino[4,5-e][1,3,4]thiadiazin-5(6H)-one, 3-[[(2,4-dichlorophenyl)methyl]thio]-1,6-dimethyl-(245728-44-3)1HNMR
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