Vitas-M small molecule compound
1,3-dimethyl-7-(4-nitrobenzyl)-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL339039
SMILES [O-][N+](=O)c1ccc(cc1)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 C19H22N6O4 MW 398.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H22N6O4/c1-21-16-15(17(26)22(2)19(21)27)24(18(20-16)23-10-4-3-5-11-23)12-13-6-8-14(9-7-13)25(28)29/h6-9H,3-5,10-12H2,1-2H3InChIKey
IKVLVKGEJWFTQD-UHFFFAOYSA-NSynonyms
953909-36-9(O)(N+)(=O)c1ccc(cc1)Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCCCC1
13dimethyl7((4nitrophenyl)methyl)8piperidin1ylpurine26dione
13dimethyl7(4nitrobenzyl)8(piperidin1yl)1Hpurine26(3H7H)dione
13dimethyl7(4nitrobenzyl)8(piperidin1yl)37dihydro1Hpurine26dione
953909369
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCCCC3)CC4=CC=C(C=C4)(N+)(=O)(O)
InChI=1SC19H22N6O4c1211615(17(26)22(2)19(21)27)24(18(2016)23104351123)12136814(9713)25(28)29h69H351012H212H3
MFCD04008187
ZINC000006413711
ZINC06413711
ZINC6413711
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