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501000-36-8

501000-36-8 Structure

501000-36-8 Structure
IdentificationBack Directory
[Name]

N-[[2-Cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-4-(4-methylpiperazin-1-yl)benzamide
[CAS]

501000-36-8
[Synonyms]

Dutacatib
Unii-L3m76J6S37
N-[[2-Cyano-4-(2,2-dimethylpropylamino)pyrimidin-5-yl]methyl]-4-(4-methylpiperazin-1-yl)benzamide
Benzamide, N-[[2-cyano-4-[(2,2-dimethylpropyl)amino]-5-pyrimidinyl]methyl]-4-(4-methyl-1-piperazinyl)-
[Molecular Formula]

C23H31N7O
[MDL Number]

MFCD13195555
[MOL File]

501000-36-8.mol
[Molecular Weight]

421.54
Chemical PropertiesBack Directory
[density ]

1.21
[pka]

14.22±0.46(Predicted)
Hazard InformationBack Directory
[Uses]

Dutacatib is inhibitor for SARS-CoV-2 3CLpro and cathepsin K, which exhibits antiviral activity and ameliorates the cancer-induced bone diseases[1][2].
[References]

[1] Sousa S, et al., Bone-Targeted Therapies in Cancer-Induced Bone Disease. Calcif Tissue Int. 2018 Feb;102(2):227-250. DOI:10.1007/s00223-017-0353-5
[2] Dayan Elshan NGR, et al., Discovery of CMX990: A Potent SARS-CoV-2 3CL Protease Inhibitor Bearing a Novel Warhead. J Med Chem. 2024 Feb 22;67(4):2369-2378. DOI:10.1021/acs.jmedchem.3c01938
501000-36-8 suppliers list
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