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2395016-49-4

2395016-49-4 Structure

2395016-49-4 Structure
IdentificationBack Directory
[Name]

Benzenesulfonic acid, 4-[(2-chlorobenzoyl)amino]-, 3-nitrophenyl ester
[CAS]

2395016-49-4
[Synonyms]

P2Y2R/GPR17 antagonist 1
Benzenesulfonic acid, 4-[(2-chlorobenzoyl)amino]-, 3-nitrophenyl ester
[Molecular Formula]

C19H13ClN2O6S
[MOL File]

2395016-49-4.mol
[Molecular Weight]

432.83
Chemical PropertiesBack Directory
[Boiling point ]

548.3±50.0 °C(Predicted)
[density ]

1.514±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 125 mg/mL (288.80 mM; Need ultrasonic)
[form ]

Solid
[pka]

11.68±0.70(Predicted)
[color ]

Light yellow to yellow
Hazard InformationBack Directory
[Uses]

P2Y2R/GPR17 antagonist 1 (Compound 14m) is a dual P2Y2R and GPR17 antagonist with IC50 values of 3.17 μM and 1.67 μM against P2Y2R and GPR17, respectively. P2Y2R/GPR17 antagonist 1 shows excellent metabolic stability in human liver microsomes[1].
[storage]

Store at -20°C
[References]

[1] Pillaiyar T, et al. Design, synthesis and biological evaluation of suramin-derived dual antagonists of the proinflammatory G protein-coupled receptors P2Y2 and GPR17. Eur J Med Chem. 2020 Jan 15;186:111789. DOI:10.1016/j.ejmech.2019.111789
Spectrum DetailBack Directory
[Spectrum Detail]

Benzenesulfonic acid, 4-[(2-chlorobenzoyl)amino]-, 3-nitrophenyl ester(2395016-49-4)1HNMR
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