Vitas-M small molecule compound
7-benzyl-1,3-dimethyl-8-{4-[(4-methylphenyl)carbonyl]piperazin-1-yl}-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK272386
SMILES Cc1ccc(cc1)C(=O)N1CCN(CC1)c1nc2c(n1Cc1ccccc1)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 C26H28N6O3 MW 472.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H28N6O3/c1-18-9-11-20(12-10-18)23(33)30-13-15-31(16-14-30)25-27-22-21(24(34)29(3)26(35)28(22)2)32(25)17-19-7-5-4-6-8-19/h4-12H,13-17H2,1-3H3InChIKey
HXCYFGSLBWOFFF-UHFFFAOYSA-NSynonyms
13DIMETHYL8(4((4METHYLPHENYL)CARBONYL)PIPERAZINYL)7BENZYL137TRIHYDROPURINE26DIONE
7benzyl13dimethyl8(4((4methylphenyl)carbonyl)piperazin1yl)37dihydro1Hpurine26dione
7benzyl13dimethyl8(4(4methylbenzoyl)piperazin1yl)purine26dione
8(4(4METHYLBENZOYL)PIPERAZIN1YL)7BENZYL13DIMETHYL37DIHYDRO1HPURINE26DIONE
CC1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=NC4=C(N3CC5=CC=CC=C5)C(=O)N(C(=O)N4C)C
InChI=1SC26H28N6O3c11891120(121018)23(33)30131531(161430)25272221(24(34)29(3)26(35)28(22)2)32(25)17197546819h412H1317H213H3
MFCD07626873
ZINC000008775391
ZINC08775391
ZINC8775391
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