6-(Difluoromethyl)-3,5-dihydroxypicolinamide - CAS 1803668-12-3
Catalog: |
BB066527 |
Product Name: |
6-(Difluoromethyl)-3,5-dihydroxypicolinamide |
CAS: |
1803668-12-3 |
Synonyms: |
6-(Difluoromethyl)-3,5-dihydroxypyridine-2-carboxamide |
IUPAC Name: | 6-(difluoromethyl)-3,5-dihydroxypyridine-2-carboxamide |
Description: | 6-(Difluoromethyl)-3,5-dihydroxypicolinamide 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(=NC(=C1O)C(=O)N)C(F)F)O |
InChI: | InChI=1S/C7H6F2N2O3/c8-6(9)4-2(12)1-3(13)5(11-4)7(10)14/h1,6,12-13H,(H2,10,14) |
InChI Key: | GLIWAILHOLNEBN-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: | 227 |
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: | 6 |
Hydrogen Bond Donor Count: | 3 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 204.03464838 |
Rotatable Bond Count: | 2 |
Topological Polar Surface Area: | 96.4Ų |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.6 |
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