Vitas-M small molecule compound
7-[2-(4-bromophenyl)-2-oxoethyl]-1,3-dimethyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK766238
SMILES CN1CCN(CC1)c1nc2c(n1CC(=O)c1ccc(cc1)Br)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 C20H23BrN6O3 MW 475.35 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H23BrN6O3/c1-23-8-10-26(11-9-23)19-22-17-16(18(29)25(3)20(30)24(17)2)27(19)12-15(28)13-4-6-14(21)7-5-13/h4-7H,8-12H2,1-3H3InChIKey
ZBDXFKAFSDVTKP-UHFFFAOYSA-NSynonyms
7(2(4bromophenyl)2oxoethyl)13dimethyl8(4methylpiperazin1yl)1Hpurine26(3H7H)dione
7(2(4bromophenyl)2oxoethyl)13dimethyl8(4methylpiperazin1yl)37dihydro1Hpurine26dione
7(2(4bromophenyl)2oxoethyl)13dimethyl8(4methylpiperazin1yl)purine26dione
CN1CCN(CC1)C2=NC3=C(N2CC(=O)C4=CC=C(C=C4)Br)C(=O)N(C(=O)N3C)C
InChI=1SC20H23BrN6O3c12381026(11923)19221716(18(29)25(3)20(30)24(17)2)27(19)1215(28)134614(21)7513h47H812H213H3
MFCD02984427
ZINC000008659788
ZINC8659788
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