Vitas-M small molecule compound
7-(3-bromobenzyl)-1,3-dimethyl-8-[4-(pyridin-2-yl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK697653
SMILES Brc1cccc(c1)Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccccn1
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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 C23H24BrN7O2 MW 510.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H24BrN7O2/c1-27-20-19(21(32)28(2)23(27)33)31(15-16-6-5-7-17(24)14-16)22(26-20)30-12-10-29(11-13-30)18-8-3-4-9-25-18/h3-9,14H,10-13,15H2,1-2H3InChIKey
IHTYKQQHUWPZNJ-UHFFFAOYSA-NSynonyms
7((3BROMOPHENYL)METHYL)13DIMETHYL8(4PYRIDIN2YLPIPERAZIN1YL)PURINE26DIONE
7(3bromobenzyl)13dimethyl8(4(pyridin2yl)piperazin1yl)1Hpurine26(3H7H)dione
7(3bromobenzyl)13dimethyl8(4(pyridin2yl)piperazin1yl)37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCN(CC3)C4=CC=CC=N4)CC5=CC(=CC=C5)Br
InChI=1SC23H24BrN7O2c1272019(21(32)28(2)23(27)33)31(151665717(24)1416)22(2620)30121029(111330)1883492518h3914H101315H212H3
MFCD02985888
ZINC000009057743
ZINC9057743
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