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2725749-22-2

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2725749-22-2 Structure

2725749-22-2 Structure
IdentificationBack Directory
[Name]

SARS-CoV-2-IN-6
[CAS]

2725749-22-2
[Synonyms]

GRL-0820
SARS-CoV-2-IN-6
[Molecular Formula]

C17H13ClN2O2
[MOL File]

2725749-22-2.mol
[Molecular Weight]

312.75
Chemical PropertiesBack Directory
[Boiling point ]

485.064±45.00 °C(Press: 760.00 Torr)(predicted)
[density ]

1.259±0.14 g/cm3(Temp: 25 °C; Press: 760 Torr)(predicted)
[form ]

Solid
[pka]

1.271±0.10(predicted)
[color ]

Off-white to light yellow
Hazard InformationBack Directory
[Uses]

SARS-CoV-2-IN-6 is a SARS-CoV-2 3CLpro inhibitor that shows the most potent enzyme inhibitory IC50 value of 73 nM.
[References]

[1] Ghosh AK, et al. Indole Chloropyridinyl Ester-Derived SARS-CoV-2 3CLpro Inhibitors: Enzyme Inhibition, Antiviral Efficacy, Structure-Activity Relationship, and X-ray Structural Studies. J Med Chem. 2021 Oct 14;64(19):14702-14714. DOI:10.1021/acs.jmedchem.1c01214
Spectrum DetailBack Directory
[Spectrum Detail]

SARS-CoV-2-IN-6(2725749-22-2)1HNMR
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