Vitas-M small molecule compound

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

Catalog ID
STK840299
SMILES OC(Cn1c(N/N=C(/c2ccccc2)\C)nc2c1c(=O)n(C)c(=O)n2C)COc1ccccc1C

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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 C25H28N6O4 MW 476.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H28N6O4/c1-16-10-8-9-13-20(16)35-15-19(32)14-31-21-22(29(3)25(34)30(4)23(21)33)26-24(31)28-27-17(2)18-11-6-5-7-12-18/h5-13,19,32H,14-15H2,1-4H3,(H,26,28)/b27-17+
InChIKey
GUKATGUIVISIMO-WPWMEQJKSA-N
Synonyms

(E)7(2hydroxy3(otolyloxy)propyl)13dimethyl8(2(1phenylethylidene)hydrazinyl)1Hpurine26(3H7H)dione
7(2hydroxy3(2methylphenoxy)propyl)13dimethyl8((2E)2(1phenylethylidene)hydrazinyl)37dihydro1Hpurine26dione
7(2hydroxy3(2methylphenoxy)propyl)13dimethyl8((2E)2(1phenylethylidene)hydrazinyl)purine26dione
CC1=CC=CC=C1OCC(CN2C3=C(N=C2NN=C(C)C4=CC=CC=C4)N(C(=O)N(C3=O)C)C)O
InChI=1SC25H28N6O4c11610891320(16)351519(32)14312122(29(3)25(34)30(4)23(21)33)2624(31)282717(2)18116571218h5131932H1415H214H3(H2628)b2717+
MFCD02242642
OC(Cn1c(NN=C(c2ccccc2)C)nc2c1c(=O)n(C)c(=O)n2C)COc1ccccc1C
ZINC000005360156
ZINC000005360166

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Available files

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