Vitas-M small molecule compound
7-(4-chlorobenzyl)-3-methyl-8-[4-(2-methylpropyl)piperazin-1-yl]-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK601508
SMILES CC(CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Cl)c(=O)[nH]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 C21H27ClN6O2 MW 430.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H27ClN6O2/c1-14(2)12-26-8-10-27(11-9-26)20-23-18-17(19(29)24-21(30)25(18)3)28(20)13-15-4-6-16(22)7-5-15/h4-7,14H,8-13H2,1-3H3,(H,24,29,30)InChIKey
ZYHRQBOFEQPFLU-UHFFFAOYSA-NSynonyms
879773-18-97((4CHLOROPHENYL)METHYL)3METHYL8(4(2METHYLPROPYL)PIPERAZIN1YL)PURINE26DIONE
7((4CHLOROPHENYL)METHYL)3METHYL8(4(2METHYLPROPYL)PIPERAZINYL)137TRIHYDROPURINE26DIONE
7(4chlorobenzyl)3methyl8(4(2methylpropyl)piperazin1yl)37dihydro1Hpurine26dione
7(4CHLOROBENZYL)8(4ISOBUTYLPIPERAZIN1YL)3METHYL1HPURINE26(3H7H)DIONE
879773189
CC(C)CN1CCN(CC1)C2=NC3=C(N2CC4=CC=C(C=C4)Cl)C(=O)NC(=O)N3C
CC(CN1CCN(CC1)c1nc2c(n1Cc1ccc(cc1)Cl)c(=O)(nH)c(=O)n2C)C
InChI=1SC21H27ClN6O2c114(2)122681027(11926)20231817(19(29)2421(30)25(18)3)28(20)13154616(22)7515h4714H813H213H3(H242930)
MFCD06792988
ZINC000008996164
ZINC8996164
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