Vitas-M small molecule compound

methyl 2-hydroxy-6-(4-hydroxy-3-methoxyphenyl)-5-(phenylcarbonyl)-1,6-dihydropyrimidine-4-carboxylate

Catalog ID
STK612679
SMILES COC(=O)C1=C(C(NC(=N1)O)c1ccc(c(c1)OC)O)C(=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 C20H18N2O6 MW 382.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H18N2O6/c1-27-14-10-12(8-9-13(14)23)16-15(18(24)11-6-4-3-5-7-11)17(19(25)28-2)22-20(26)21-16/h3-10,16,23H,1-2H3,(H2,21,22,26)
InChIKey
XHDZKCSCWZRSCR-UHFFFAOYSA-N
Synonyms
903191-77-5
903191775
COC1=C(C=CC(=C1)C2C(=C(NC(=O)N2)C(=O)OC)C(=O)C3=CC=CC=C3)O
InChI=1SC20H18N2O6c127141012(8913(14)23)1615(18(24)116435711)17(19(25)282)2220(26)2116h3101623H12H3(H2212226)
methyl2hydroxy6(4hydroxy3methoxyphenyl)5(phenylcarbonyl)16dihydropyrimidine4carboxylate
methyl5benzoyl4(4hydroxy3methoxyphenyl)2oxo34dihydro1Hpyrimidine6carboxylate
MFCD09793597
ZINC000006759539
ZINC000006759540

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Available files

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