Vitas-M small molecule compound

8-bromo-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK834359
SMILES CCCCCCn1c(Br)nc2c1c(=O)[nH]c(=O)n2C

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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 C12H17BrN4O2 MW 329.20 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H17BrN4O2/c1-3-4-5-6-7-17-8-9(14-11(17)13)16(2)12(19)15-10(8)18/h3-7H2,1-2H3,(H,15,18,19)
InChIKey
MJYKLJLQDSIZFD-UHFFFAOYSA-N
Synonyms
123980-55-2
123980552
8BROMO7HEXYL3METHYL137TRIHYDROPURINE26DIONE
8bromo7hexyl3methyl1Hpurine26(3H7H)dione
8bromo7hexyl3methyl37dihydro1Hpurine26dione
8BROMO7HEXYL3METHYL37DIHYDROPURINE26DIONE
8BROMO7HEXYL3METHYLPURINE26DIONE
CCCCCCn1c(Br)nc2c1c(=O)(nH)c(=O)n2C
CCCCCCN1C2=C(N=C1Br)N(C(=O)NC2=O)C
InChI=1SC12H17BrN4O2c1345671789(1411(17)13)16(2)12(19)1510(8)18h37H212H3(H151819)
MFCD00630708
ZINC000002027179
ZINC02027179
ZINC2027179

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Available files

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