Vitas-M small molecule compound
7-[2-hydroxy-3-(2-methylphenoxy)propyl]-8-{[3-(1H-imidazol-1-yl)propyl]amino}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK840714
SMILES OC(Cn1c(NCCCn2cncc2)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 C23H29N7O4 MW 467.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29N7O4/c1-16-7-4-5-8-18(16)34-14-17(31)13-30-19-20(27(2)23(33)28(3)21(19)32)26-22(30)25-9-6-11-29-12-10-24-15-29/h4-5,7-8,10,12,15,17,31H,6,9,11,13-14H2,1-3H3,(H,25,26)InChIKey
ZEVVDQUUGVZHMS-UHFFFAOYSA-NSynonyms
333755-53-6333755536
7(2hydroxy3(2methylphenoxy)propyl)8((3(1Himidazol1yl)propyl)amino)13dimethyl37dihydro1Hpurine26dione
7(2HYDROXY3(2METHYLPHENOXY)PROPYL)8(3IMIDAZOL1YLPROPYLAMINO)13DIMETHYLPURINE26DIONE
8((3(1HIMIDAZOL1YL)PROPYL)AMINO)7(2HYDROXY3(OTOLYLOXY)PROPYL)13DIMETHYL1HPURINE26(3H7H)DIONE
CC1=CC=CC=C1OCC(CN2C3=C(N=C2NCCCN4C=CN=C4)N(C(=O)N(C3=O)C)C)O
InChI=1SC23H29N7O4c116745818(16)341417(31)13301920(27(2)23(33)28(3)21(19)32)2622(30)259611291210241529h45781012151731H69111314H213H3(H2526)
MFCD02579156
ZINC000001833189
ZINC000005358423
ZINC04633661
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