Vitas-M small molecule compound

8-(4-bromophenoxy)-7-(2-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK030934
SMILES Brc1ccc(cc1)Oc1nc2c(n1Cc1ccccc1F)c(=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 C20H16BrFN4O3 MW 459.27 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H16BrFN4O3/c1-24-17-16(18(27)25(2)20(24)28)26(11-12-5-3-4-6-15(12)22)19(23-17)29-14-9-7-13(21)8-10-14/h3-10H,11H2,1-2H3
InChIKey
RRICCIYKUGLGLK-UHFFFAOYSA-N
Synonyms
327100-72-1
327100721
8(4BROMOPHENOXY)7((2FLUOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8(4bromophenoxy)7(2fluorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8(4BROMOPHENOXY)7(2FLUOROBENZYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
Brc1ccc(cc1)Oc1nc2c(n1Cc1ccccc1F)c(=O)n(c(=O)n2C)C
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=C(C=C3)Br)CC4=CC=CC=C4F
InChI=1SC20H16BrFN4O3c1241716(18(27)25(2)20(24)28)26(1112534615(12)22)19(2317)29149713(21)81014h310H11H212H3
MFCD01554816
STK030934
ZINC000008926363
ZINC08926363
ZINC8926363

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Available files

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