5-(Difluoromethyl)-2-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxamide - CAS 1805328-60-2
Catalog: |
BB066528 |
Product Name: |
5-(Difluoromethyl)-2-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxamide |
CAS: |
1805328-60-2 |
Synonyms: |
5-(Difluoromethyl)-2,6-dihydroxypyridine-3-carboxamide |
IUPAC Name: | 5-(difluoromethyl)-2-hydroxy-6-oxo-1H-pyridine-3-carboxamide |
Description: | 5-(Difluoromethyl)-2-hydroxy-6-oxo-1,6-dihydropyridine-3-carboxamide is a building block related to Favipiravir(F103350). Favipiravir is used for the treatment of advanced Ebola virus infection in a small animal model. Favipiravir suppressed the replication of Zaire Ebola virus and prevented a lethal outcome in 100% of the animals. Based on the studies, Favipiravir can be a candidate for the treatment of Ebola hemorrhagic fever. |
Molecular Weight: | 204.13 |
Molecular Formula: | C7H6F2N2O3 |
Canonical SMILES: | C1=C(C(=O)NC(=C1C(=O)N)O)C(F)F |
InChI: | InChI=1S/C7H6F2N2O3/c8-4(9)2-1-3(5(10)12)7(14)11-6(2)13/h1,4H,(H2,10,12)(H2,11,13,14) |
InChI Key: | MDVTZHBUCUIHHA-UHFFFAOYSA-N |
References: | Oestereich, L., et al. Antiviral Res., 105, 17 (2014); Baranovich, T., et al. J. Virol. 87, 3741 (2013); Chem. and Eng. News p.8, Dec. 1 (2014). |
Complexity: | 360 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 204.03464838 |
Formal Charge: | 0 |
Heavy Atom Count: | 14 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.03464838 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 92.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | -0.2 |
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