Vitas-M small molecule compound

8-{[4-(2-fluorophenyl)piperazin-1-yl]methyl}-1,3-dimethyl-7-(2-methylbenzyl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK584451
SMILES Cc1ccccc1Cn1c(CN2CCN(CC2)c2ccccc2F)nc2c1c(=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 C26H29FN6O2 MW 476.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H29FN6O2/c1-18-8-4-5-9-19(18)16-33-22(28-24-23(33)25(34)30(3)26(35)29(24)2)17-31-12-14-32(15-13-31)21-11-7-6-10-20(21)27/h4-11H,12-17H2,1-3H3
InChIKey
NUKGFOKIMPGUQY-UHFFFAOYSA-N
Synonyms
851938-24-4
8((4(2FLUOROPHENYL)PIPERAZIN1YL)METHYL)13DIMETHYL7((2METHYLPHENYL)METHYL)PURINE26DIONE
8((4(2fluorophenyl)piperazin1yl)methyl)13dimethyl7(2methylbenzyl)1Hpurine26(3H7H)dione
8((4(2fluorophenyl)piperazin1yl)methyl)13dimethyl7(2methylbenzyl)37dihydro1Hpurine26dione
8((4(2FLUOROPHENYL)PIPERAZINYL)METHYL)13DIMETHYL7((2METHYLPHENYL)METHYL)137TRIHYDROPURINE26DIONE
851938244
CC1=CC=CC=C1CN2C(=NC3=C2C(=O)N(C(=O)N3C)C)CN4CCN(CC4)C5=CC=CC=C5F
InChI=1SC26H29FN6O2c118845919(18)163322(282423(33)25(34)30(3)26(35)29(24)2)1731121432(151331)2111761020(21)27h411H1217H213H3
MFCD04466327
ZINC000057111024
ZINC57111024

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Available files

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