Vitas-M small molecule compound
1,1'-(benzene-1,4-diyldimethanediyl)bis(7-benzyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione)
Catalog ID
STK677891
SMILES O=c1n(Cc2ccc(cc2)Cn2c(=O)c3n(cnc3n(c2=O)C)Cc2ccccc2)c(=O)c2c(n1C)ncn2Cc1ccccc1
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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 C34H30N8O4 MW 614.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H30N8O4/c1-37-29-27(39(21-35-29)17-23-9-5-3-6-10-23)31(43)41(33(37)45)19-25-13-15-26(16-14-25)20-42-32(44)28-30(38(2)34(42)46)36-22-40(28)18-24-11-7-4-8-12-24/h3-16,21-22H,17-20H2,1-2H3InChIKey
FIGBEGPSWQHYFP-UHFFFAOYSA-NSynonyms
11(benzene14diyldimethanediyl)bis(7benzyl3methyl37dihydro1Hpurine26dione)
3METHYL1((4((3METHYL26DIOXO7BENZYL(137TRIHYDROPURINYL))METHYL)PHENYL)METHYL)7BENZYL137TRIHYDROPURINE26DIONE
7BENZYL1((4((7BENZYL3METHYL26DIOXOPURIN1YL)METHYL)PHENYL)METHYL)3METHYLPURINE26DIONE
CN1C2=C(C(=O)N(C1=O)CC3=CC=C(C=C3)CN4C(=O)C5=C(N=CN5CC6=CC=CC=C6)N(C4=O)C)N(C=N2)CC7=CC=CC=C7
InChI=1SC34H30N8O4c1372927(39(213529)172395361023)31(43)41(33(37)45)1925131526(161425)204232(44)2830(38(2)34(42)46)362240(28)1824117481224h3162122H1720H212H3
MFCD02934966
ZINC000033354648
ZINC33354648
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