Vitas-M small molecule compound
8-(azepan-1-yl)-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK834089
SMILES CCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCCC1
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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 C18H29N5O2 MW 347.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H29N5O2/c1-3-4-5-10-13-23-14-15(21(2)18(25)20-16(14)24)19-17(23)22-11-8-6-7-9-12-22/h3-13H2,1-2H3,(H,20,24,25)InChIKey
GEXJVGYWRITSSH-UHFFFAOYSA-NSynonyms
300388-89-0300388890
8(azepan1yl)7hexyl3methyl1Hpurine26(3H7H)dione
8(azepan1yl)7hexyl3methyl37dihydro1Hpurine26dione
8(AZEPAN1YL)7HEXYL3METHYLPURINE26DIONE
8AZAPERHYDROEPINYL7HEXYL3METHYL137TRIHYDROPURINE26DIONE
8AZEPAN1YL7HEXYL3METHYL37DIHYDROPURINE26DIONE
CCCCCCn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCCCCC1
CCCCCCN1C2=C(N=C1N3CCCCCC3)N(C(=O)NC2=O)C
InChI=1SC18H29N5O2c13451013231415(21(2)18(25)2016(14)24)1917(23)221186791222h313H212H3(H202425)
MFCD00658368
ZINC000002255609
ZINC02255609
ZINC2255609
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