Vitas-M small molecule compound

8-(2,5-dimethylphenoxy)-7-(4-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK097372
SMILES Fc1ccc(cc1)Cn1c(Oc2cc(C)ccc2C)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 C22H21FN4O3 MW 408.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H21FN4O3/c1-13-5-6-14(2)17(11-13)30-21-24-19-18(20(28)26(4)22(29)25(19)3)27(21)12-15-7-9-16(23)10-8-15/h5-11H,12H2,1-4H3
InChIKey
DGYNBHYFUUYEDO-UHFFFAOYSA-N
Synonyms
317843-23-5
317843235
8(25DIMETHYLPHENOXY)7((4FLUOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8(25dimethylphenoxy)7(4fluorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8(25DIMETHYLPHENOXY)7(4FLUOROBENZYL)13DIMETHYL37DIHYDRO1HPURINE26DIONE
CC1=CC(=C(C=C1)C)OC2=NC3=C(N2CC4=CC=C(C=C4)F)C(=O)N(C(=O)N3C)C
Fc1ccc(cc1)Cn1c(Oc2cc(C)ccc2C)nc2c1c(=O)n(C)c(=O)n2C
InChI=1SC22H21FN4O3c1135614(2)17(1113)3021241918(20(28)26(4)22(29)25(19)3)27(21)12157916(23)10815h511H12H214H3
MFCD01556418
STK097372
ZINC000013739123
ZINC13739123

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Available files

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