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ChemicalBook--->CAS DataBase List--->2170477-75-3

2170477-75-3

2170477-75-3 Structure

2170477-75-3 Structure
IdentificationBack Directory
[Name]

Benzeneacetic acid, 4-[[[[[2,6-dichloro-2'-(trifluoromethoxy)[1,1'-biphenyl]-4-yl]amino]carbonyl]amino]methyl]-
[CAS]

2170477-75-3
[Synonyms]

RORγt inverse agonist 13
Benzeneacetic acid, 4-[[[[[2,6-dichloro-2'-(trifluoromethoxy)[1,1'-biphenyl]-4-yl]amino]carbonyl]amino]methyl]-
[Molecular Formula]

C23H17Cl2F3N2O4
[MOL File]

2170477-75-3.mol
[Molecular Weight]

513.29
Chemical PropertiesBack Directory
[Boiling point ]

552.9±50.0 °C(Predicted)
[density ]

1.470±0.06 g/cm3(Predicted)
[storage temp. ]

Store at -20°C
[solubility ]

DMSO : 100 mg/mL (194.82 mM; Need ultrasonic)
[form ]

Solid
[pka]

4.30±0.10(Predicted)
[color ]

White to off-white
Hazard InformationBack Directory
[Biological Activity]

RORγt inverse agonist 13 (Compound 3i) is a potent, orally active and selective RORγt inverse agonist, with improved drug-like properties, with an IC50 of 63.8 nM[1]. RORγt inverse agonist 13 (Compound 3i) exhibits activity with an inhibition of 76% at 0.3 μM in Th17 cell differentiation assay[1]. RORγt inverse agonist 13 (Compound 3i, 25 mg/kg, Orally, twice daily) demonstrats excellent in vivo PK profile in mice and good in vivo efficacy in an IMQ-induced psoriasis mice model[1].
[storage]

Store at -20°C
[References]

[1]. Nannan Sun, et al. Discovery of carboxyl-containing biaryl ureas as potent RORγt inverse agonists. Eur J Med Chem. 2020 Jul 5;202:112536.
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