Vitas-M small molecule compound
2-[1,3-dimethyl-8-(4-methylpiperazin-1-yl)-2,6-dioxo-1,2,3,6-tetrahydro-7H-purin-7-yl]ethyl 3,4,5-trimethoxybenzoate
Catalog ID
STK532441
SMILES COc1cc(cc(c1OC)OC)C(=O)OCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCN(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 C24H32N6O7 MW 516.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H32N6O7/c1-26-7-9-29(10-8-26)23-25-20-18(21(31)28(3)24(33)27(20)2)30(23)11-12-37-22(32)15-13-16(34-4)19(36-6)17(14-15)35-5/h13-14H,7-12H2,1-6H3InChIKey
QRMDCHXLHNULLP-UHFFFAOYSA-NSynonyms
2(13dimethyl8(4methylpiperazin1yl)26dioxo1236tetrahydro7Hpurin7yl)ethyl345trimethoxybenzoate
2(13dimethyl8(4methylpiperazin1yl)26dioxo23dihydro1Hpurin7(6H)yl)ethyl345trimethoxybenzoatehydrochloride
2(13DIMETHYL8(4METHYLPIPERAZIN1YL)26DIOXOPURIN7YL)ETHYL345TRIMETHOXYBENZOATE
CN1CCN(CC1)C2=NC3=C(N2CCOC(=O)C4=CC(=C(C(=C4)OC)OC)OC)C(=O)N(C(=O)N3C)C
COc1cc(cc(c1OC)OC)C(=O)OCCn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCN(CC1)CCl
InChI=1SC24H32N6O7c1267929(10826)23252018(21(31)28(3)24(33)27(20)2)30(23)11123722(32)151316(344)19(366)17(1415)355h1314H712H216H3
MFCD02991970
ZINC000008817861
ZINC8817861
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