Vitas-M small molecule compound

5-(4,5-dimethoxy-3-oxo-1,3-dihydro-2-benzofuran-1-yl)-6-hydroxy-1-(4-methylphenyl)pyrimidine-2,4(1H,3H)-dione

Catalog ID
STL343604
SMILES COc1c(OC)ccc2c1C(=O)OC2c1c(=O)[nH]c(=O)n(c1O)c1ccc(cc1)C

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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 C21H18N2O7 MW 410.38 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18N2O7/c1-10-4-6-11(7-5-10)23-19(25)15(18(24)22-21(23)27)16-12-8-9-13(28-2)17(29-3)14(12)20(26)30-16/h4-9,16,25H,1-3H3,(H,22,24,27)
InChIKey
ASHVCSOGERZLMH-UHFFFAOYSA-N
Synonyms
491606-75-8
491606758
5((1S)45DIMETHOXY3OXO13DIHYDRO2BENZOFURAN1YL)6HYDROXY1(4METHYLPHENYL)PYRIMIDINE24(1H3H)DIONE
5(45dimethoxy3oxo13dihydro2benzofuran1yl)6hydroxy1(4methylphenyl)pyrimidine24(1H3H)dione
5(45dimethoxy3oxo13dihydroisobenzofuran1yl)6hydroxy1(ptolyl)pyrimidine24(1H3H)dione
5(45DIMETHOXY3OXO1H2BENZOFURAN1YL)6HYDROXY1(4METHYLPHENYL)PYRIMIDINE24DIONE
CC1=CC=C(C=C1)N2C(=C(C(=O)NC2=O)C3C4=C(C(=C(C=C4)OC)OC)C(=O)O3)O
COc1c(OC)ccc2c1C(=O)OC2c1c(=O)(nH)c(=O)n(c1O)c1ccc(cc1)C
InChI=1SC21H18N2O7c1104611(7510)2319(25)15(18(24)2221(23)27)16128913(282)17(293)14(12)20(26)3016h491625H13H3(H222427)
MFCD01942214
ZINC000002415514
ZINC000002415515

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Available files

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