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ChemicalBook--->CAS DataBase List--->1417700-13-0

1417700-13-0

1417700-13-0 Structure

1417700-13-0 Structure
IdentificationBack Directory
[Name]

ML188
[CAS]

1417700-13-0
[Synonyms]

ML188
(R)-N-(4-(tert-Butyl)phenyl)-N-(2-(tert-butylamino)-2-oxo-1-(pyridin-3-yl)ethyl)furan-2-carboxamide
3-Pyridineacetamide, N-(1,1-dimethylethyl)-α-[[4-(1,1-dimethylethyl)phenyl](2-furanylcarbonyl)amino]-, (αR)-
[Molecular Formula]

C26H31N3O3
[MDL Number]

MFCD32693920
[MOL File]

1417700-13-0.mol
[Molecular Weight]

433.54
Chemical PropertiesBack Directory
[Boiling point ]

630.7±55.0 °C(Predicted)
[density ]

1.142±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,2-8°C
[solubility ]

DMSO: 250 mg/mL (576.65 mM)
[form ]

Solid
[pka]

14.24±0.46(Predicted)
[color ]

White to Off-White
Safety DataBack Directory
[Symbol(GHS) ]


GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
Hazard InformationBack Directory
[Uses]

ML188 is a ligand with the potential to bind and potentially inhibit SARS-CoV-2 main protease.
[Definition]

ChEBI: N-[(1R)-2-(tert-butylamino)-2-oxo-1-(3-pyridinyl)ethyl]-N-(4-tert-butylphenyl)-2-furancarboxamide is a member of furans and an aromatic amide.
[storage]

Store at -20°C
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