Vitas-M small molecule compound

(5Z)-5-{4-[(4-fluorobenzyl)oxy]-3-methoxybenzylidene}-1-phenylpyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK014801
SMILES COc1cc(ccc1OCc1ccc(cc1)F)/C=C\1/C(=O)NC(=O)N(C1=O)c1ccccc1

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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 C25H19FN2O5 MW 446.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19FN2O5/c1-32-22-14-17(9-12-21(22)33-15-16-7-10-18(26)11-8-16)13-20-23(29)27-25(31)28(24(20)30)19-5-3-2-4-6-19/h2-14H,15H2,1H3,(H,27,29,31)/b20-13-
InChIKey
LVHCNVDGVLSKAK-MOSHPQCFSA-N
Synonyms

(5Z)5((4((4FLUOROPHENYL)METHOXY)3METHOXYPHENYL)METHYLIDENE)1PHENYL13DIAZINANE246TRIONE
(5Z)5(4((4FLUOROBENZYL)OXY)3METHOXYBENZYLIDENE)1PHENYLPYRIMIDINE246(1H3H5H)TRIONE
COC1=C(C=CC(=C1)C=C2C(=O)NC(=O)N(C2=O)C3=CC=CC=C3)OCC4=CC=C(C=C4)F
COc1cc(ccc1OCc1ccc(cc1)F)C=C1C(=O)NC(=O)N(C1=O)c1ccccc1
InChI=1SC25H19FN2O5c132221417(91221(22)33151671018(26)11816)132023(29)2725(31)28(24(20)30)195324619h214H15H21H3(H272931)b2013
MFCD02634114
STK014801
ZINC000001201465
ZINC01201465
ZINC1201465

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Available files

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