Vitas-M small molecule compound
4-[(4-{(Z)-[1-(3-fluorophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}-2-methoxyphenoxy)methyl]benzoic acid
Catalog ID
STK617161
SMILES COc1cc(ccc1OCc1ccc(cc1)C(=O)O)/C=C\1/C(=NC(=O)N(C1=O)c1cccc(c1)F)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 C26H19FN2O7 MW 490.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H19FN2O7/c1-35-22-12-16(7-10-21(22)36-14-15-5-8-17(9-6-15)25(32)33)11-20-23(30)28-26(34)29(24(20)31)19-4-2-3-18(27)13-19/h2-13H,14H2,1H3,(H,32,33)(H,28,30,34)/b20-11-InChIKey
PKQKELHNWBQZMZ-JAIQZWGSSA-NSynonyms
348575-81-5348575815
4((4((1(3FLUOROPHENYL)246TRIOXO(13DIHYDROPYRIMIDIN5YLIDENE))METHYL)2METHOXYPHENOXY)METHYL)BENZOICACID
4((4((Z)(1(3FLUOROPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)2METHOXYPHENOXY)METHYL)BENZOICACID
4((4((Z)(1(3fluorophenyl)4hydroxy26dioxo16dihydropyrimidin5(2H)ylidene)methyl)2methoxyphenoxy)methyl)benzoicacid
COc1cc(ccc1OCc1ccc(cc1)C(=O)O)C=C1C(=NC(=O)N(C1=O)c1cccc(c1)F)O
InChI=1SC26H19FN2O7c135221216(71021(22)3614155817(9615)25(32)33)112023(30)2826(34)29(24(20)31)1942318(27)1319h213H14H21H3(H3233)(H283034)b2011
MFCD08731579
ZINC000012419359
ZINC12419359
Check stock
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Check stock on Vitas-MAvailable files
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