Vitas-M small molecule compound
8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-phenylethyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK580453
SMILES COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1CCc1ccccc1)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 C27H32N6O3 MW 488.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H32N6O3/c1-29-25-24(26(34)30(2)27(29)35)33(14-13-20-7-5-4-6-8-20)23(28-25)19-31-15-17-32(18-16-31)21-9-11-22(36-3)12-10-21/h4-12H,13-19H2,1-3H3InChIKey
RSYKGTVBQDQOPN-UHFFFAOYSA-NSynonyms
851943-39-08((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl7(2phenylethyl)37dihydro1Hpurine26dione
8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl7(2phenylethyl)purine26dione
8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl7phenethyl1Hpurine26(3H7H)dione
8((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL7PHENETHYLPURINE26DIONE
8((4(4METHOXYPHENYL)PIPERAZINYL)METHYL)13DIMETHYL7(2PHENYLETHYL)137TRIHYDROPURINE26DIONE
851943390
CN1C2=C(C(=O)N(C1=O)C)N(C(=N2)CN3CCN(CC3)C4=CC=C(C=C4)OC)CCC5=CC=CC=C5
InChI=1SC27H32N6O3c1292524(26(34)30(2)27(29)35)33(1413207546820)23(2825)1931151732(181631)2191122(363)121021h412H1319H213H3
MFCD04466759
ZINC000057105662
ZINC57105662
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