Vitas-M small molecule compound
8-[(6-aminohexyl)amino]-7-(2-chlorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL322635
SMILES NCCCCCCNc1nc2c(n1Cc1ccccc1Cl)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 C20H27ClN6O2 MW 418.93 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H27ClN6O2/c1-25-17-16(18(28)26(2)20(25)29)27(13-14-9-5-6-10-15(14)21)19(24-17)23-12-8-4-3-7-11-22/h5-6,9-10H,3-4,7-8,11-13,22H2,1-2H3,(H,23,24)InChIKey
IGMFIOCDDJOTJO-UHFFFAOYSA-NSynonyms
8((6aminohexyl)amino)7(2chlorobenzyl)13dimethyl1Hpurine26(3H7H)dionehydrochloride
8((6aminohexyl)amino)7(2chlorobenzyl)13dimethyl37dihydro1Hpurine26dione
8(6AMINOHEXYLAMINO)7((2CHLOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NCCCCCCN)CC3=CC=CC=C3Cl
InChI=1SC20H27ClN6O2c1251716(18(28)26(2)20(25)29)27(13149561015(14)21)19(2417)231284371122h56910H3478111322H212H3(H2324)
MFCD01554563
NCCCCCCNc1nc2c(n1Cc1ccccc1Cl)c(=O)n(c(=O)n2C)CCl
ZINC000013512745
ZINC13512745
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