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ChemicalBook--->CAS DataBase List--->1660114-31-7

1660114-31-7

1660114-31-7 Structure

1660114-31-7 Structure
IdentificationBack Directory
[Name]

NIK SMI1
[CAS]

1660114-31-7
[Synonyms]

NIK SMI1
NIK inhibitor 4f(NIK SMI1)
(R)-6-(3-((3-Hydroxy-1-methyl-2-oxopyrrolidin-3-yl)ethynyl)phenyl)-4-methoxypicolinamide
2-Pyridinecarboxamide, 6-[3-[2-[(3R)-3-hydroxy-1-methyl-2-oxo-3-pyrrolidinyl]ethynyl]phenyl]-4-methoxy-
[Molecular Formula]

C20H19N3O4
[MDL Number]

MFCD31715434
[MOL File]

1660114-31-7.mol
[Molecular Weight]

365.38
Chemical PropertiesBack Directory
[Boiling point ]

626.7±55.0 °C(Predicted)
[density ]

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

Store at -20°C
[solubility ]

DMSO : 100 mg/mL (273.69 mM)
[form ]

Solid
[pka]

11.14±0.20(Predicted)
[color ]

Off-white to pink
Hazard InformationBack Directory
[Uses]

NIK SMI1 is a highly potent and selective NF-κB-inducing kinase (NIK) inhibitor.
[Biological Activity]

NIK SMI1 is an orally activeATP site-targetingpotent and selective NF-KB-inducing kinase inhibitor (h/m NIK IC50 = 230/395 pM; hKHS1/hPKD1/hLRRK2 = 49.6/75.2/247.8 nM) th at selectively disrupts noncanonical NF-KB signaling (anti-LTβR-induced p52 nuclear translocation IC50 = 70 nM; TNFα-induced p65 RelA nuclear translocation IC50 >2 μM). SMI1 inhibits BAFF receptor- and CD40-mediated singling in cultures (human and murine B-cells) and shows in vivo efficacy in the NZB/W F1 murine experimental lupus model (6-400 mg/kg/dayb.i.d. p.o.).
[storage]

Store at -20°C
Spectrum DetailBack Directory
[Spectrum Detail]

NIK SMI1(1660114-31-7)1HNMR
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