Vitas-M small molecule compound

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

Catalog ID
STL296030
SMILES Brc1ccc(cc1)Oc1nc2c(n1Cc1c(F)cccc1Cl)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 C20H15BrClFN4O3 MW 493.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H15BrClFN4O3/c1-25-17-16(18(28)26(2)20(25)29)27(10-13-14(22)4-3-5-15(13)23)19(24-17)30-12-8-6-11(21)7-9-12/h3-9H,10H2,1-2H3
InChIKey
XNYWODCMIXJXCO-UHFFFAOYSA-N
Synonyms
305865-08-1
305865081
8(4BROMOPHENOXY)7((2CHLORO6FLUOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8(4bromophenoxy)7(2chloro6fluorobenzyl)13dimethyl1Hpurine26(3H7H)dione
8(4bromophenoxy)7(2chloro6fluorobenzyl)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OC3=CC=C(C=C3)Br)CC4=C(C=CC=C4Cl)F
InChI=1SC20H15BrClFN4O3c1251716(18(28)26(2)20(25)29)27(101314(22)43515(13)23)19(2417)30128611(21)7912h39H10H212H3
MFCD01553844
ZINC000008926319
ZINC08926319
ZINC8926319

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Available files

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