Vitas-M small molecule compound
8-(azepan-1-yl)-3-methyl-7-nonyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK528423
SMILES CCCCCCCCCn1c(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 C21H35N5O2 MW 389.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H35N5O2/c1-3-4-5-6-7-8-13-16-26-17-18(24(2)21(28)23-19(17)27)22-20(26)25-14-11-9-10-12-15-25/h3-16H2,1-2H3,(H,23,27,28)InChIKey
OIVKAWYENSMDFI-UHFFFAOYSA-NSynonyms
302799004
8(AZEPAN1YL)3METHYL7NONYL1HPURINE26(3H7H)DIONE
8(azepan1yl)3methyl7nonyl37dihydro1Hpurine26dione
8(AZEPAN1YL)3METHYL7NONYLPURINE26DIONE
8AZAPERHYDROEPINYL3METHYL7NONYL137TRIHYDROPURINE26DIONE
8AZEPAN1YL3METHYL7NONYL37DIHYDROPURINE26DIONE
CCCCCCCCCn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCCCCC1
CCCCCCCCCN1C2=C(N=C1N3CCCCCC3)N(C(=O)NC2=O)C
InChI=1SC21H35N5O2c13456781316261718(24(2)21(28)2319(17)27)2220(26)251411910121525h316H212H3(H232728)
MFCD00690169
ZINC000002288897
ZINC2288897
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