Vitas-M small molecule compound

8-chloro-1,3-dimethyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK667516
SMILES CCCCCCCCn1c(Cl)nc2c1c(=O)n(C)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 C15H23ClN4O2 MW 326.83 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H23ClN4O2/c1-4-5-6-7-8-9-10-20-11-12(17-14(20)16)18(2)15(22)19(3)13(11)21/h4-10H2,1-3H3
InChIKey
LLVISTSJRDWXPS-UHFFFAOYSA-N
Synonyms

8chloro13dimethyl7octyl37dihydro1Hpurine26dione
8CHLORO13DIMETHYL7OCTYLPURINE26DIONE
CCCCCCCCN1C2=C(N=C1Cl)N(C(=O)N(C2=O)C)C
InChI=1SC15H23ClN4O2c145678910201112(1714(20)16)18(2)15(22)19(3)13(11)21h410H213H3
MFCD01836821
ZINC000029747265
ZINC29747265

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.