Vitas-M small molecule compound
methyl 5-{3-amino-3-oxo-1-[4-(trifluoromethyl)phenyl]propyl}-4,6-dihydroxypyridine-3-carboxylate
Catalog ID
STL423249
SMILES COC(=O)c1cnc(c(c1O)C(c1ccc(cc1)C(F)(F)F)CC(=O)N)O
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C17H15F3N2O5 MW 384.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H15F3N2O5/c1-27-16(26)11-7-22-15(25)13(14(11)24)10(6-12(21)23)8-2-4-9(5-3-8)17(18,19)20/h2-5,7,10H,6H2,1H3,(H2,21,23)(H2,22,24,25)InChIKey
QNUZKDJHNBFOOO-UHFFFAOYSA-NSynonyms
COC(=O)C1=CNC(=O)C(=C1O)C(CC(=O)N)C2=CC=C(C=C2)C(F)(F)F
InChI=1SC17H15F3N2O5c12716(26)1172215(25)13(14(11)24)10(612(21)23)8249(538)17(1819)20h25710H6H21H3(H22123)(H2222425)
methyl5(3amino3oxo1(4(trifluoromethyl)phenyl)propyl)46dihydroxypyridine3carboxylate
methyl5(3amino3oxo1(4(trifluoromethyl)phenyl)propyl)4hydroxy6oxo1Hpyridine3carboxylate
MFCD30708644
ZINC000252497712
ZINC000252497713
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