57341-12-5

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57341-12-5 Structure

Identification	Back Directory
[Name] 1,4-Naphthalenedione, 2-(phenylthio)-
[CAS] 57341-12-5
[Synonyms] SARS-CoV-2-IN-80 1,4-Naphthalenedione, 2-(phenylthio)-
[Molecular Formula] C16H10O2S
[MOL File] 57341-12-5.mol
[Molecular Weight] 266.31

Chemical Properties	Back Directory
[Melting point ] 142-143 °C(Solv: methanol (67-56-1))
[Boiling point ] 427.6±45.0 °C(Predicted)
[density ] 1.34±0.1 g/cm3(Predicted)

Hazard Information	Back Directory
[Uses] SARS-CoV-2-IN-80 (compound 13) is a potent SARS-CoV-2 3CLpro inhibitor with an IC50 value of 0.964 μM[1].
[References] [1] Koharazawa R, et al. Exploring 2-methyl-substituted vitamin K3 derivatives with potent inhibitory activity against the 3CL protease of SARS-CoV-2. Bioorg Med Chem Lett. 2024 Mar 1;100:129642. DOI:10.1016/j.bmcl.2024.129642

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