Vitas-M small molecule compound
8-(1,4-diazepan-1-yl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK207342
SMILES O=c1c2[nH]c(nc2n(c(=O)n1C)C)N1CCNCCC1
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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 C12H18N6O2 MW 278.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H18N6O2/c1-16-9-8(10(19)17(2)12(16)20)14-11(15-9)18-6-3-4-13-5-7-18/h13H,3-7H2,1-2H3,(H,14,15)InChIKey
MYWZLNSGAJEJRX-UHFFFAOYSA-NSynonyms
8(14diazepan1yl)13dimethyl37dihydro1Hpurine26dione
8(14DIAZEPAN1YL)13DIMETHYL7HPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)NC(=N2)N3CCCNCC3
InChI=1SC12H18N6O2c11698(10(19)17(2)12(16)20)1411(159)18634135718h13H37H212H3(H1415)
MFCD06240506
O=c1c2(nH)c(nc2n(c(=O)n1C)C)N1CCNCCC1
ZINC000003716229
ZINC3716229
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