Vitas-M small molecule compound

(5Z)-5-{4-[(2-fluorobenzyl)oxy]benzylidene}-1-(4-methoxyphenyl)pyrimidine-2,4,6(1H,3H,5H)-trione

Catalog ID
STK028192
SMILES COc1ccc(cc1)N1C(=O)NC(=O)/C(=C/c2ccc(cc2)OCc2ccccc2F)/C1=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 C25H19FN2O5 MW 446.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H19FN2O5/c1-32-19-12-8-18(9-13-19)28-24(30)21(23(29)27-25(28)31)14-16-6-10-20(11-7-16)33-15-17-4-2-3-5-22(17)26/h2-14H,15H2,1H3,(H,27,29,31)/b21-14-
InChIKey
BBRHFXGOVSVYHD-STZFKDTASA-N
Synonyms

(5Z)5((4((2FLUOROPHENYL)METHOXY)PHENYL)METHYLIDENE)1(4METHOXYPHENYL)13DIAZINANE246TRIONE
(5Z)5(4((2FLUOROBENZYL)OXY)BENZYLIDENE)1(4METHOXYPHENYL)PYRIMIDINE246(1H3H5H)TRIONE
COC1=CC=C(C=C1)N2C(=O)C(=CC3=CC=C(C=C3)OCC4=CC=CC=C4F)C(=O)NC2=O
COc1ccc(cc1)N1C(=O)NC(=O)C(=Cc2ccc(cc2)OCc2ccccc2F)C1=O
InChI=1SC25H19FN2O5c1321912818(91319)2824(30)21(23(29)2725(28)31)141661020(11716)331517423522(17)26h214H15H21H3(H272931)b2114
MFCD02212299
STK028192
ZINC000006645241
ZINC06645241
ZINC6645241

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Available files

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