Vitas-M small molecule compound

8-amino-7-[2-hydroxy-3-(4-methylphenoxy)propyl]-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK852026
SMILES Cc1ccc(cc1)OCC(Cn1c(N)nc2c1c(=O)n(C)c(=O)n2C)O

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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 C17H21N5O4 MW 359.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C17H21N5O4/c1-10-4-6-12(7-5-10)26-9-11(23)8-22-13-14(19-16(22)18)20(2)17(25)21(3)15(13)24/h4-7,11,23H,8-9H2,1-3H3,(H2,18,19)
InChIKey
YMMGTCKTYJHVQG-UHFFFAOYSA-N
Synonyms
850730-88-0
850730880
8amino7(2hydroxy3(4methylphenoxy)propyl)13dimethyl37dihydro1Hpurine26dione
8AMINO7(2HYDROXY3(4METHYLPHENOXY)PROPYL)13DIMETHYLPURINE26DIONE
8amino7(2hydroxy3(ptolyloxy)propyl)13dimethyl1Hpurine26(3H7H)dione
CC1=CC=C(C=C1)OCC(CN2C3=C(N=C2N)N(C(=O)N(C3=O)C)C)O
InChI=1SC17H21N5O4c1104612(7510)26911(23)8221314(1916(22)18)20(2)17(25)21(3)15(13)24h471123H89H213H3(H21819)
MFCD05693000
ZINC000002398845
ZINC000002398846

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Available files

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