Vitas-M small molecule compound
7-[2-(3-methoxyphenyl)-2-oxoethyl]-1,3-dimethyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL329177
SMILES COc1cccc(c1)C(=O)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCC1
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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 C21H25N5O4 MW 411.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H25N5O4/c1-23-18-17(19(28)24(2)21(23)29)26(20(22-18)25-10-5-4-6-11-25)13-16(27)14-8-7-9-15(12-14)30-3/h7-9,12H,4-6,10-11,13H2,1-3H3InChIKey
KFTZHZWIJLZRRJ-UHFFFAOYSA-NSynonyms
7(2(3methoxyphenyl)2oxoethyl)13dimethyl8(piperidin1yl)1Hpurine26(3H7H)dione
7(2(3METHOXYPHENYL)2OXOETHYL)13DIMETHYL8(PIPERIDIN1YL)37DIHYDRO1HPURINE26DIONE
7(2(3METHOXYPHENYL)2OXOETHYL)13DIMETHYL8PIPERIDIN1YLPURINE26DIONE
7(2(3METHOXYPHENYL)2OXOETHYL)13DIMETHYL8PIPERIDYL137TRIHYDROPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CC(=O)C4=CC(=CC=C4)OC
InChI=1SC21H25N5O4c1231817(19(28)24(2)21(23)29)26(20(2218)25105461125)1316(27)1487915(1214)303h7912H46101113H213H3
MFCD02241739
ZINC000000968771
ZINC00968771
ZINC968771
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