Vitas-M small molecule compound

2-(5-{(E)-[1-(3-bromophenyl)-4-hydroxy-2,6-dioxo-1,6-dihydropyrimidin-5(2H)-ylidene]methyl}furan-2-yl)benzoic acid

Catalog ID
STK601010
SMILES Brc1cccc(c1)N1C(=O)N=C(/C(=C\c2ccc(o2)c2ccccc2C(=O)O)/C1=O)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 C22H13BrN2O6 MW 481.26 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H13BrN2O6/c23-12-4-3-5-13(10-12)25-20(27)17(19(26)24-22(25)30)11-14-8-9-18(31-14)15-6-1-2-7-16(15)21(28)29/h1-11H,(H,28,29)(H,24,26,30)/b17-11+
InChIKey
FPJXRMDDZDEFOV-GZTJUZNOSA-N
Synonyms
340306-51-6
Brc1cccc(c1)N1C(=O)N=C(C(=Cc2ccc(o2)c2ccccc2C(=O)O)C1=O)O
MFCD08733650
ZINC000013810557

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.