Vitas-M small molecule compound

1,3,7-trimethyl-8-(pyridin-2-yloxy)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK697674
SMILES Cn1c(Oc2ccccn2)nc2c1c(=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 C13H13N5O3 MW 287.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H13N5O3/c1-16-9-10(17(2)13(20)18(3)11(9)19)15-12(16)21-8-6-4-5-7-14-8/h4-7H,1-3H3
InChIKey
CADFKCJQFVUSKS-UHFFFAOYSA-N
Synonyms
728036-37-1
137trimethyl8(pyridin2yloxy)1Hpurine26(3H7H)dione
137trimethyl8(pyridin2yloxy)37dihydro1Hpurine26dione
137TRIMETHYL8PYRIDIN2YLOXYPURINE26DIONE
1HPURINE26DIONE37DIHYDRO137TRIMETHYL8(2PYRIDINYLOXY)
728036371
CN1C2=C(N=C1OC3=CC=CC=N3)N(C(=O)N(C2=O)C)C
InChI=1SC13H13N5O3c116910(17(2)13(20)18(3)11(9)19)1512(16)2186457148h47H13H3
MFCD04164684
ZINC000000537344
ZINC00537344
ZINC537344

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Available files

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