Vitas-M small molecule compound
1-(2-fluorobenzyl)-3,7-dimethyl-8-(3-methylphenoxy)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL296044
SMILES Cc1cccc(c1)Oc1nc2c(n1C)c(=O)n(c(=O)n2C)Cc1ccccc1F
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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 C21H19FN4O3 MW 394.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN4O3/c1-13-7-6-9-15(11-13)29-20-23-18-17(24(20)2)19(27)26(21(28)25(18)3)12-14-8-4-5-10-16(14)22/h4-11H,12H2,1-3H3InChIKey
VAKQLCHKLFXDLE-UHFFFAOYSA-NSynonyms
370074-33-21((2fluorophenyl)methyl)37dimethyl8(3methylphenoxy)purine26dione
1(2fluorobenzyl)37dimethyl8(3methylphenoxy)37dihydro1Hpurine26dione
1(2fluorobenzyl)37dimethyl8(mtolyloxy)1Hpurine26(3H7H)dione
370074332
CC1=CC(=CC=C1)OC2=NC3=C(N2C)C(=O)N(C(=O)N3C)CC4=CC=CC=C4F
InChI=1SC21H19FN4O3c11376915(1113)2920231817(24(20)2)19(27)26(21(28)25(18)3)12148451016(14)22h411H12H213H3
MFCD01555502
ZINC000005387327
ZINC05387327
ZINC5387327
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