Vitas-M small molecule compound

7-(4-fluorobenzyl)-8-[(2E)-2-(3-hydroxybenzylidene)hydrazinyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK840173
SMILES Fc1ccc(cc1)Cn1c(N/N=C/c2cccc(c2)O)nc2c1c(=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 C21H19FN6O3 MW 422.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H19FN6O3/c1-26-18-17(19(30)27(2)21(26)31)28(12-13-6-8-15(22)9-7-13)20(24-18)25-23-11-14-4-3-5-16(29)10-14/h3-11,29H,12H2,1-2H3,(H,24,25)/b23-11+
InChIKey
OUOHZOLDXIOCFG-FOKLQQMPSA-N
Synonyms
(E)7(4fluorobenzyl)8(2(3hydroxybenzylidene)hydrazinyl)13dimethyl1Hpurine26(3H7H)dione
7((4fluorophenyl)methyl)8((2E)2((3hydroxyphenyl)methylidene)hydrazinyl)13dimethylpurine26dione
7(4fluorobenzyl)8((2E)2(3hydroxybenzylidene)hydrazinyl)13dimethyl37dihydro1Hpurine26dione
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)NN=CC3=CC(=CC=C3)O)CC4=CC=C(C=C4)F
Fc1ccc(cc1)Cn1c(NN=Cc2cccc(c2)O)nc2c1c(=O)n(c(=O)n2C)C
Registry IDs
MFCD02982581
ZINC000008913886
ZINC56900458

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Available files

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