Vitas-M small molecule compound
8-(4-ethylpiperazin-1-yl)-6-hydroxy-7-[2-hydroxy-3-(3-methylphenoxy)propyl]-3-methyl-3,7-dihydro-2H-purin-2-one
Catalog ID
STK573148
SMILES CCN1CCN(CC1)c1nc2c(n1CC(COc1cccc(c1)C)O)c(O)nc(=O)n2C
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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 C22H30N6O4 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N6O4/c1-4-26-8-10-27(11-9-26)21-23-19-18(20(30)24-22(31)25(19)3)28(21)13-16(29)14-32-17-7-5-6-15(2)12-17/h5-7,12,16,29H,4,8-11,13-14H2,1-3H3,(H,24,30,31)InChIKey
WMZDEFZBROWWQA-UHFFFAOYSA-NSynonyms
862489-83-68(4ethylpiperazin1yl)6hydroxy7(2hydroxy3(3methylphenoxy)propyl)3methyl37dihydro2Hpurin2one
8(4ETHYLPIPERAZIN1YL)7(2HYDROXY3(3METHYLPHENOXY)PROPYL)3METHYLPURINE26DIONE
8(4ETHYLPIPERAZIN1YL)7(2HYDROXY3(MTOLYLOXY)PROPYL)3METHYL1HPURINE26(3H7H)DIONE
862489836
CCN1CCN(CC1)C2=NC3=C(N2CC(COC4=CC=CC(=C4)C)O)C(=O)NC(=O)N3C
InChI=1SC22H30N6O4c142681027(11926)21231918(20(30)2422(31)25(19)3)28(21)1316(29)14321775615(2)1217h57121629H48111314H213H3(H243031)
MFCD07199060
ZINC000009292593
ZINC000009292594
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