Vitas-M small molecule compound
8-{[4-(4-methoxyphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK597292
SMILES COc1ccc(cc1)N1CCN(CC1)Cc1nc2c(n1Cc1cccc(c1)C)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/c1-19-6-5-7-20(16-19)17-33-23(28-25-24(33)26(34)30(3)27(35)29(25)2)18-31-12-14-32(15-13-31)21-8-10-22(36-4)11-9-21/h5-11,16H,12-15,17-18H2,1-4H3InChIKey
SXYUSNJQYPAVAP-UHFFFAOYSA-NSynonyms
839679-92-48((4(4METHOXYPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL7((3METHYLPHENYL)METHYL)PURINE26DIONE
8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl7(3methylbenzyl)1Hpurine26(3H7H)dione
8((4(4methoxyphenyl)piperazin1yl)methyl)13dimethyl7(3methylbenzyl)37dihydro1Hpurine26dione
8((4(4METHOXYPHENYL)PIPERAZINYL)METHYL)13DIMETHYL7((3METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
839679924
CC1=CC(=CC=C1)CN2C(=NC3=C2C(=O)N(C(=O)N3C)C)CN4CCN(CC4)C5=CC=C(C=C5)OC
InChI=1SC27H32N6O3c11965720(1619)173323(282524(33)26(34)30(3)27(35)29(25)2)1831121432(151331)2181022(364)11921h51116H12151718H214H3
MFCD04466383
ZINC000055560074
ZINC55560074
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