Vitas-M small molecule compound

8-[(2E)-2-(3,4-dimethoxybenzylidene)hydrazinyl]-7-[2-hydroxy-3-(2-methylphenoxy)propyl]-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK526912
SMILES COc1cc(/C=N/Nc2nc3c(n2CC(COc2ccccc2C)O)c(=O)[nH]c(=O)n3C)ccc1OC

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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 C25H28N6O6 MW 508.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O6/c1-15-7-5-6-8-18(15)37-14-17(32)13-31-21-22(30(2)25(34)28-23(21)33)27-24(31)29-26-12-16-9-10-19(35-3)20(11-16)36-4/h5-12,17,32H,13-14H2,1-4H3,(H,27,29)(H,28,33,34)/b26-12+
InChIKey
AXUVDLUWFATSNL-RPPGKUMJSA-N
Synonyms
372082-39-8
(E)8(2(34dimethoxybenzylidene)hydrazinyl)7(2hydroxy3(otolyloxy)propyl)3methyl1Hpurine26(3H7H)dione
8((2E)2((34dimethoxyphenyl)methylidene)hydrazinyl)7(2hydroxy3(2methylphenoxy)propyl)3methylpurine26dione
8((2E)2(34dimethoxybenzylidene)hydrazinyl)7(2hydroxy3(2methylphenoxy)propyl)3methyl37dihydro1Hpurine26dione
CC1=CC=CC=C1OCC(CN2C3=C(N=C2NN=CC4=CC(=C(C=C4)OC)OC)N(C(=O)NC3=O)C)O
COc1cc(C=NNc2nc3c(n2CC(COc2ccccc2C)O)c(=O)(nH)c(=O)n3C)ccc1OC
Registry IDs
MFCD01876034
ZINC000013232336
ZINC000013232339

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Available files

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