Vitas-M small molecule compound
8-[(4-benzylpiperazin-1-yl)methyl]-1,3-dimethyl-7-(2-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK578045
SMILES Cc1ccccc1Cn1c(CN2CCN(CC2)Cc2ccccc2)nc2c1c(=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 C27H32N6O2 MW 472.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N6O2/c1-20-9-7-8-12-22(20)18-33-23(28-25-24(33)26(34)30(3)27(35)29(25)2)19-32-15-13-31(14-16-32)17-21-10-5-4-6-11-21/h4-12H,13-19H2,1-3H3InChIKey
IKUPCIZGFDJTDZ-UHFFFAOYSA-NSynonyms
851938-22-213DIMETHYL7((2METHYLPHENYL)METHYL)8((4BENZYLPIPERAZINYL)METHYL)137TRIHYDROPURINE26DIONE
8((4BENZYLPIPERAZIN1YL)METHYL)13DIMETHYL7((2METHYLPHENYL)METHYL)PURINE26DIONE
8((4benzylpiperazin1yl)methyl)13dimethyl7(2methylbenzyl)1Hpurine26(3H7H)dione
8((4benzylpiperazin1yl)methyl)13dimethyl7(2methylbenzyl)37dihydro1Hpurine26dione
851938222
CC1=CC=CC=C1CN2C(=NC3=C2C(=O)N(C(=O)N3C)C)CN4CCN(CC4)CC5=CC=CC=C5
InChI=1SC27H32N6O2c1209781222(20)183323(282524(33)26(34)30(3)27(35)29(25)2)1932151331(141632)1721105461121h412H1319H213H3
MFCD04466325
ZINC000020517576
ZINC20517576
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