Vitas-M small molecule compound
8-(4-butanoylphenoxy)-7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK773550
SMILES CCCC(=O)c1ccc(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 C24H22ClFN4O4 MW 484.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H22ClFN4O4/c1-4-6-19(31)14-9-11-15(12-10-14)34-23-27-21-20(22(32)29(3)24(33)28(21)2)30(23)13-16-17(25)7-5-8-18(16)26/h5,7-12H,4,6,13H2,1-3H3InChIKey
VTMYKXPPUSEQSX-UHFFFAOYSA-NSynonyms
8(4BUTANOYLPHENOXY)7((2CHLORO6FLUOROPHENYL)METHYL)13DIMETHYLPURINE26DIONE
8(4butanoylphenoxy)7(2chloro6fluorobenzyl)13dimethyl37dihydro1Hpurine26dione
CCCC(=O)C1=CC=C(C=C1)OC2=NC3=C(N2CC4=C(C=CC=C4Cl)F)C(=O)N(C(=O)N3C)C
InChI=1SC24H22ClFN4O4c14619(31)1491115(121014)3423272120(22(32)29(3)24(33)28(21)2)30(23)131617(25)75818(16)26h5712H4613H213H3
MFCD03855060
ZINC000001080524
ZINC01080524
ZINC1080524
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