Vitas-M small molecule compound
7-(2-chloro-6-fluorobenzyl)-1,3-dimethyl-8-(prop-2-yn-1-yloxy)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK697861
SMILES C#CCOc1nc2c(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 C17H14ClFN4O3 MW 376.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H14ClFN4O3/c1-4-8-26-16-20-14-13(15(24)22(3)17(25)21(14)2)23(16)9-10-11(18)6-5-7-12(10)19/h1,5-7H,8-9H2,2-3H3InChIKey
PLEJQHCHHJMWTH-UHFFFAOYSA-NSynonyms
327099-03-6327099036
7((2CHLORO6FLUOROPHENYL)METHYL)13DIMETHYL8PROP2YNOXYPURINE26DIONE
7(2chloro6fluorobenzyl)13dimethyl8(prop2yn1yloxy)1Hpurine26(3H7H)dione
7(2chloro6fluorobenzyl)13dimethyl8(prop2yn1yloxy)37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)OCC#C)CC3=C(C=CC=C3Cl)F
InChI=1SC17H14ClFN4O3c1482616201413(15(24)22(3)17(25)21(14)2)23(16)91011(18)65712(10)19h157H89H223H3
MFCD01554674
ZINC000013512820
ZINC13512820
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