Vitas-M small molecule compound
5,5'-({3-[(2-fluorobenzyl)oxy]phenyl}methanediyl)bis(6-hydroxypyrimidine-2,4(1H,3H)-dione)
Catalog ID
STL418628
SMILES O=c1[nH]c(O)c(c(=O)[nH]1)C(c1c(O)[nH]c(=O)[nH]c1=O)c1cccc(c1)OCc1ccccc1F
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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 C22H17FN4O7 MW 468.40 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H17FN4O7/c23-13-7-2-1-4-11(13)9-34-12-6-3-5-10(8-12)14(15-17(28)24-21(32)25-18(15)29)16-19(30)26-22(33)27-20(16)31/h1-8,14H,9H2,(H3,24,25,28,29,32)(H3,26,27,30,31,33)InChIKey
PKVQVTWJYCBKNV-UHFFFAOYSA-NSynonyms
5((3((2FLUOROPHENYL)METHOXY)PHENYL)(6HYDROXY24DIOXO1HPYRIMIDIN5YL)METHYL)6HYDROXY1HPYRIMIDINE24DIONE
55((3((2fluorobenzyl)oxy)phenyl)methanediyl)bis(6hydroxypyrimidine24(1H3H)dione)
C1=CC=C(C(=C1)COC2=CC=CC(=C2)C(C3=C(NC(=O)NC3=O)O)C4=C(NC(=O)NC4=O)O)F
InChI=1SC22H17FN4O7c2313721411(13)9341263510(812)14(1517(28)2421(32)2518(15)29)1619(30)2622(33)2720(16)31h1814H9H2(H32425282932)(H32627303133)
MFCD02614851
O=c1(nH)c(O)c(c(=O)(nH)1)C(c1c(O)(nH)c(=O)(nH)c1=O)c1cccc(c1)OCc1ccccc1F
ZINC000009310224
ZINC9310224
Check stock
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