Vitas-M small molecule compound
8-{[4-(5-chloro-2-methylphenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(3-methylbutyl)-3,7-dihydro-1H-purine-2,6-dione
Catalog ID
STK589559
SMILES CC(CCn1c(CN2CCN(CC2)c2cc(Cl)ccc2C)nc2c1c(=O)n(c(=O)n2C)C)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 C24H33ClN6O2 MW 473.02 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H33ClN6O2/c1-16(2)8-9-31-20(26-22-21(31)23(32)28(5)24(33)27(22)4)15-29-10-12-30(13-11-29)19-14-18(25)7-6-17(19)3/h6-7,14,16H,8-13,15H2,1-5H3InChIKey
NEWZPBLDLSYIAH-UHFFFAOYSA-NSynonyms
893945-96-58((4(5chloro2methylphenyl)piperazin1yl)methyl)13dimethyl7(3methylbutyl)37dihydro1Hpurine26dione
8((4(5CHLORO2METHYLPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL7(3METHYLBUTYL)PURINE26DIONE
8((4(5chloro2methylphenyl)piperazin1yl)methyl)7isopentyl13dimethyl1Hpurine26(3H7H)dione
8((4(5CHLORO2METHYLPHENYL)PIPERAZINYL)METHYL)13DIMETHYL7(3METHYLBUTYL)137TRIHYDROPURINE26DIONE
893945965
CC1=C(C=C(C=C1)Cl)N2CCN(CC2)CC3=NC4=C(N3CCC(C)C)C(=O)N(C(=O)N4C)C
InChI=1SC24H33ClN6O2c116(2)893120(262221(31)23(32)28(5)24(33)27(22)4)1529101230(131129)191418(25)7617(19)3h671416H81315H215H3
MFCD06611174
ZINC000057120999
ZINC57120999
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