Vitas-M small molecule compound
7-[2-hydroxy-3-(3-methylphenoxy)propyl]-1,3-dimethyl-8-(piperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK576882
SMILES Cc1cccc(c1)OCC(Cn1c(nc2c1c(=O)n(C)c(=O)n2C)N1CCNCC1)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 C21H28N6O4 MW 428.49 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H28N6O4/c1-14-5-4-6-16(11-14)31-13-15(28)12-27-17-18(24(2)21(30)25(3)19(17)29)23-20(27)26-9-7-22-8-10-26/h4-6,11,15,22,28H,7-10,12-13H2,1-3H3InChIKey
ORNANMLDALUHMR-UHFFFAOYSA-NSynonyms
850824-49-67(2hydroxy3(3methylphenoxy)propyl)13dimethyl8(piperazin1yl)37dihydro1Hpurine26dione
7(2HYDROXY3(3METHYLPHENOXY)PROPYL)13DIMETHYL8PIPERAZIN1YLPURINE26DIONE
7(2hydroxy3(mtolyloxy)propyl)13dimethyl8(piperazin1yl)1Hpurine26(3H7H)dione
850824496
CC1=CC(=CC=C1)OCC(CN2C3=C(N=C2N4CCNCC4)N(C(=O)N(C3=O)C)C)O
InChI=1SC21H28N6O4c11454616(1114)311315(28)12271718(24(2)21(30)25(3)19(17)29)2320(27)26972281026h4611152228H7101213H213H3
MFCD05694058
ZINC000009291112
ZINC000009291113
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