Vitas-M small molecule compound

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

Catalog ID
STL326423
SMILES OC(Cn1c(N/N=C(/c2ccccc2)\C)nc2c1c(=O)[nH]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 C24H26N6O4 MW 462.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H26N6O4/c1-15-9-7-8-12-19(15)34-14-18(31)13-30-20-21(29(3)24(33)26-22(20)32)25-23(30)28-27-16(2)17-10-5-4-6-11-17/h4-12,18,31H,13-14H2,1-3H3,(H,25,28)(H,26,32,33)/b27-16+
InChIKey
OXTIBSLMMUAGAS-JVWAILMASA-N
Synonyms
372153-89-4
(E)7(2hydroxy3(otolyloxy)propyl)3methyl8(2(1phenylethylidene)hydrazinyl)1Hpurine26(3H7H)dione
372153894
7(2hydroxy3(2methylphenoxy)propyl)3methyl8((2E)2(1phenylethylidene)hydrazinyl)37dihydro1Hpurine26dione
7(2hydroxy3(2methylphenoxy)propyl)3methyl8((2E)2(1phenylethylidene)hydrazinyl)purine26dione
CC1=CC=CC=C1OCC(CN2C3=C(N=C2NN=C(C)C4=CC=CC=C4)N(C(=O)NC3=O)C)O
InChI=1SC24H26N6O4c1159781219(15)341418(31)13302021(29(3)24(33)2622(20)32)2523(30)282716(2)17105461117h4121831H1314H213H3(H2528)(H263233)b2716+
MFCD01878370
OC(Cn1c(NN=C(c2ccccc2)C)nc2c1c(=O)(nH)c(=O)n2C)COc1ccccc1C
ZINC000013764455
ZINC000013764458

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Available files

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