Vitas-M small molecule compound
8-(4-butanoylphenoxy)-7-(3,4-diethoxybenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK770265
SMILES CCCC(=O)c1ccc(cc1)Oc1nc2c(n1Cc1ccc(c(c1)OCC)OCC)c(=O)n(c(=O)n2C)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 C28H32N4O6 MW 520.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O6/c1-6-9-21(33)19-11-13-20(14-12-19)38-27-29-25-24(26(34)31(5)28(35)30(25)4)32(27)17-18-10-15-22(36-7-2)23(16-18)37-8-3/h10-16H,6-9,17H2,1-5H3InChIKey
WZABSPDNEGQZML-UHFFFAOYSA-NSynonyms
8(4BUTANOYLPHENOXY)7((34DIETHOXYPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8(4butanoylphenoxy)7(34diethoxybenzyl)13dimethyl37dihydro1Hpurine26dione
CCCC(=O)C1=CC=C(C=C1)OC2=NC3=C(N2CC4=CC(=C(C=C4)OCC)OCC)C(=O)N(C(=O)N3C)C
InChI=1SC28H32N4O6c16921(33)19111320(141219)3827292524(26(34)31(5)28(35)30(25)4)32(27)1718101522(3672)23(1618)3783h1016H6917H215H3
MFCD03765925
ZINC000000719988
ZINC00719988
ZINC719988
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