Vitas-M small molecule compound
7-(2,5-dimethylbenzyl)-8-{[4-(furan-2-ylcarbonyl)piperazin-1-yl]methyl}-1,3-dimethyl-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK850045
SMILES Cc1ccc(c(c1)Cn1c(CN2CCN(CC2)C(=O)c2ccco2)nc2c1c(=O)n(c(=O)n2C)C)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 C26H30N6O4 MW 490.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H30N6O4/c1-17-7-8-18(2)19(14-17)15-32-21(27-23-22(32)25(34)29(4)26(35)28(23)3)16-30-9-11-31(12-10-30)24(33)20-6-5-13-36-20/h5-8,13-14H,9-12,15-16H2,1-4H3InChIKey
JKSDPXTUYMTMCA-UHFFFAOYSA-NSynonyms
851939-13-47((25DIMETHYLPHENYL)METHYL)8((4(2FURYLCARBONYL)PIPERAZINYL)METHYL)13DIMETHYL137TRIHYDROPURINE26DIONE
7((25DIMETHYLPHENYL)METHYL)8((4(FURAN2CARBONYL)PIPERAZIN1YL)METHYL)13DIMETHYLPURINE26DIONE
7(25dimethylbenzyl)8((4(furan2carbonyl)piperazin1yl)methyl)13dimethyl1Hpurine26(3H7H)dione
7(25dimethylbenzyl)8((4(furan2ylcarbonyl)piperazin1yl)methyl)13dimethyl37dihydro1Hpurine26dione
851939134
CC1=CC(=C(C=C1)C)CN2C(=NC3=C2C(=O)N(C(=O)N3C)C)CN4CCN(CC4)C(=O)C5=CC=CO5
InChI=1SC26H30N6O4c1177818(2)19(1417)153221(272322(32)25(34)29(4)26(35)28(23)3)163091131(121030)24(33)2065133620h581314H9121516H214H3
MFCD04466412
ZINC000020518480
ZINC20518480
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