Vitas-M small molecule compound
8-(4-benzylpiperazin-1-yl)-3-methyl-7-octyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK540691
SMILES CCCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)Cc1ccccc1
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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 C25H36N6O2 MW 452.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36N6O2/c1-3-4-5-6-7-11-14-31-21-22(28(2)25(33)27-23(21)32)26-24(31)30-17-15-29(16-18-30)19-20-12-9-8-10-13-20/h8-10,12-13H,3-7,11,14-19H2,1-2H3,(H,27,32,33)InChIKey
YCRKLRGWNWWHDA-UHFFFAOYSA-NSynonyms
377060-82-7377060827
3METHYL7OCTYL8(4BENZYLPIPERAZINYL)137TRIHYDROPURINE26DIONE
8(4benzylpiperazin1yl)3methyl7octyl1Hpurine26(3H7H)dione
8(4benzylpiperazin1yl)3methyl7octyl37dihydro1Hpurine26dione
8(4BENZYLPIPERAZIN1YL)3METHYL7OCTYLPURINE26DIONE
CCCCCCCCn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCN(CC1)Cc1ccccc1
CCCCCCCCN1C2=C(N=C1N3CCN(CC3)CC4=CC=CC=C4)N(C(=O)NC2=O)C
InChI=1SC25H36N6O2c1345671114312122(28(2)25(33)2723(21)32)2624(31)30171529(161830)19201298101320h8101213H37111419H212H3(H273233)
MFCD02983729
ZINC000095551095
ZINC95551095
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