Vitas-M small molecule compound

1,3-dimethyl-8-phenoxy-7-(prop-2-en-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STL380109
SMILES C=CCn1c(Oc2ccccc2)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 C16H16N4O3 MW 312.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H16N4O3/c1-4-10-20-12-13(18(2)16(22)19(3)14(12)21)17-15(20)23-11-8-6-5-7-9-11/h4-9H,1,10H2,2-3H3
InChIKey
JQJBKQKRPASGEC-UHFFFAOYSA-N
Synonyms

13dimethyl8phenoxy7(prop2en1yl)37dihydro1Hpurine26dione
13DIMETHYL8PHENOXY7PROP2ENYLPURINE26DIONE
7ALLYL13DIMETHYL8PHENOXY37DIHYDROPURINE26DIONE
7ALLYL13DIMETHYL8PHENOXYXANTHINE
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=CC=C3)CC=C
InChI=1SC16H16N4O3c1410201213(18(2)16(22)19(3)14(12)21)1715(20)23118657911h49H110H223H3
MFCD03714336
ZINC000000202065
ZINC00202065
ZINC202065

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Available files

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