Vitas-M small molecule compound
7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL343801
SMILES CN1CCN(CC1)c1nc2c(n1CC(COc1ccccc1)O)c(=O)n(c(=O)n2C)C
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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/c1-23-9-11-26(12-10-23)20-22-18-17(19(29)25(3)21(30)24(18)2)27(20)13-15(28)14-31-16-7-5-4-6-8-16/h4-8,15,28H,9-14H2,1-3H3InChIKey
BIWMSCMHHHZPHB-UHFFFAOYSA-NSynonyms
845804-55-97(2HYDROXY3PHENOXYPROPYL)13DIMETHYL8(4METHYLPIPERAZIN1YL)1HPURINE26(3H7H)DIONE
7(2hydroxy3phenoxypropyl)13dimethyl8(4methylpiperazin1yl)37dihydro1Hpurine26dione
7(2HYDROXY3PHENOXYPROPYL)13DIMETHYL8(4METHYLPIPERAZIN1YL)PURINE26DIONE
845804559
CN1CCN(CC1)C2=NC3=C(N2CC(COC4=CC=CC=C4)O)C(=O)N(C(=O)N3C)C
InChI=1SC21H28N6O4c12391126(121023)20221817(19(29)25(3)21(30)24(18)2)27(20)1315(28)1431167546816h481528H914H213H3
MFCD04170053
ZINC000009282240
ZINC000009282241
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