Vitas-M small molecule compound

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

Catalog ID
STK847587
SMILES CC(CCn1c(CN2CCN(CC2)C(=O)c2ccco2)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 C22H30N6O4 MW 442.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H30N6O4/c1-15(2)7-8-28-17(23-19-18(28)21(30)25(4)22(31)24(19)3)14-26-9-11-27(12-10-26)20(29)16-6-5-13-32-16/h5-6,13,15H,7-12,14H2,1-4H3
InChIKey
AGUUKKXWABRVBZ-UHFFFAOYSA-N
Synonyms
851941-94-1
8((4(2FURANYL(OXO)METHYL)1PIPERAZINYL)METHYL)13DIMETHYL7(3METHYLBUTYL)PURINE26DIONE
8((4(2FUROYL)PIPERAZINO)METHYL)7ISOAMYL13DIMETHYLXANTHINE
8((4(2FURYLCARBONYL)PIPERAZINYL)METHYL)13DIMETHYL7(3METHYLBUTYL)137TRIHYDROPURINE26DIONE
8((4(FURAN2CARBONYL)PIPERAZIN1YL)METHYL)13DIMETHYL7(3METHYLBUTYL)PURINE26DIONE
8((4(FURAN2CARBONYL)PIPERAZIN1YL)METHYL)7ISOPENTYL13DIMETHYL1HPURINE26(3H7H)DIONE
8((4(furan2ylcarbonyl)piperazin1yl)methyl)13dimethyl7(3methylbutyl)37dihydro1Hpurine26dione
8((4(FURAN2YLCARBONYL)PIPERAZIN1YL)METHYL)13DIMETHYL7(3METHYLBUTYL)PURINE26DIONE
851941941
CC(C)CCN1C(=NC2=C1C(=O)N(C(=O)N2C)C)CN3CCN(CC3)C(=O)C4=CC=CO4
InChI=1SC22H30N6O4c115(2)782817(231918(28)21(30)25(4)22(31)24(19)3)142691127(121026)20(29)1665133216h561315H71214H214H3
MFCD04466683
ZINC000020533290
ZINC20533290

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Available files

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