Vitas-M small molecule compound
8-[4-(2-hydroxyethyl)piperazin-1-yl]-7-(2-hydroxy-3-phenoxypropyl)-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STL343292
SMILES OCCN1CCN(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 C22H30N6O5 MW 458.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N6O5/c1-24-19-18(20(31)25(2)22(24)32)28(14-16(30)15-33-17-6-4-3-5-7-17)21(23-19)27-10-8-26(9-11-27)12-13-29/h3-7,16,29-30H,8-15H2,1-2H3InChIKey
YKUXHUHAOIAMSL-UHFFFAOYSA-NSynonyms
844837-27-07(2hydroxy3phenoxypropyl)8(4(2hydroxyethyl)piperazin1yl)13dimethyl1Hpurine26(3H7H)dione
8(4(2hydroxyethyl)piperazin1yl)7(2hydroxy3phenoxypropyl)13dimethyl37dihydro1Hpurine26dione
8(4(2HYDROXYETHYL)PIPERAZIN1YL)7(2HYDROXY3PHENOXYPROPYL)13DIMETHYLPURINE26DIONE
844837270
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)N3CCN(CC3)CCO)CC(COC4=CC=CC=C4)O
InChI=1SC22H30N6O5c1241918(20(31)25(2)22(24)32)28(1416(30)1533176435717)21(2319)2710826(91127)121329h37162930H815H212H3
MFCD04164237
ZINC000020358406
ZINC000020358407
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