Vitas-M small molecule compound

(4-{(E)-[1-(2-fluorophenyl)-2,4,6-trioxotetrahydropyrimidin-5(2H)-ylidene]methyl}phenoxy)acetic acid

Catalog ID
STK767172
SMILES OC(=O)COc1ccc(cc1)/C=C/1\C(=O)NC(=O)N(C1=O)c1ccccc1F

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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 C19H13FN2O6 MW 384.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H13FN2O6/c20-14-3-1-2-4-15(14)22-18(26)13(17(25)21-19(22)27)9-11-5-7-12(8-6-11)28-10-16(23)24/h1-9H,10H2,(H,23,24)(H,21,25,27)/b13-9+
InChIKey
NVPVFFMZDATEQL-UKTHLTGXSA-N
Synonyms
374084-69-2
(4((E)(1(2fluorophenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
(E)2(4((1(2fluorophenyl)246trioxotetrahydropyrimidin5(2H)ylidene)methyl)phenoxy)aceticacid
2(4((E)(1(2FLUOROPHENYL)246TRIOXO13DIAZINAN5YLIDENE)METHYL)PHENOXY)ACETICACID
374084692
C1=CC=C(C(=C1)N2C(=O)C(=CC3=CC=C(C=C3)OCC(=O)O)C(=O)NC2=O)F
InChI=1SC19H13FN2O6c2014312415(14)2218(26)13(17(25)2119(22)27)9115712(8611)281016(23)24h19H10H2(H2324)(H212527)b139+
MFCD01949981
OC(=O)COc1ccc(cc1)C=C1C(=O)NC(=O)N(C1=O)c1ccccc1F
ZINC000000706534
ZINC706534

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Available files

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