Vitas-M small molecule compound
7-[2-hydroxy-3-(2-methylphenoxy)propyl]-1,3-dimethyl-8-(4-phenylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK555763
SMILES OC(Cn1c(nc2c1c(=O)n(c(=O)n2C)C)N1CCN(CC1)c1ccccc1)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 C27H32N6O4 MW 504.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N6O4/c1-19-9-7-8-12-22(19)37-18-21(34)17-33-23-24(29(2)27(36)30(3)25(23)35)28-26(33)32-15-13-31(14-16-32)20-10-5-4-6-11-20/h4-12,21,34H,13-18H2,1-3H3InChIKey
GCFQONNJAZHNFU-UHFFFAOYSA-NSynonyms
536719-31-0536719310
7(2hydroxy3(2methylphenoxy)propyl)13dimethyl8(4phenylpiperazin1yl)37dihydro1Hpurine26dione
7(2HYDROXY3(2METHYLPHENOXY)PROPYL)13DIMETHYL8(4PHENYLPIPERAZIN1YL)PURINE26DIONE
7(2hydroxy3(otolyloxy)propyl)13dimethyl8(4phenylpiperazin1yl)1Hpurine26(3H7H)dione
CC1=CC=CC=C1OCC(CN2C3=C(N=C2N4CCN(CC4)C5=CC=CC=C5)N(C(=O)N(C3=O)C)C)O
InChI=1SC27H32N6O4c1199781222(19)371821(34)17332324(29(2)27(36)30(3)25(23)35)2826(33)32151331(141632)20105461120h4122134H1318H213H3
MFCD03417525
ZINC000000634886
ZINC000000634889
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