Vitas-M small molecule compound

7-(butan-2-yl)-3-methyl-8-(4-methylpiperazin-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK527308
SMILES CCC(n1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCN(CC1)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 C15H24N6O2 MW 320.39 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H24N6O2/c1-5-10(2)21-11-12(19(4)15(23)17-13(11)22)16-14(21)20-8-6-18(3)7-9-20/h10H,5-9H2,1-4H3,(H,17,22,23)
InChIKey
ISBCDRWCQCZASP-UHFFFAOYSA-N
Synonyms
332103-58-9
332103589
3METHYL8(4METHYLPIPERAZINYL)7(METHYLPROPYL)137TRIHYDROPURINE26DIONE
7(butan2yl)3methyl8(4methylpiperazin1yl)37dihydro1Hpurine26dione
7(SECBUTYL)3METHYL8(4METHYLPIPERAZIN1YL)1HPURINE26(3H7H)DIONE
7BUTAN2YL3METHYL8(4METHYLPIPERAZIN1YL)PURINE26DIONE
7SECBUTYL3METHYL8(4METHYLPIPERAZIN1YL)37DIHYDROPURINE26DIONE
CCC(C)N1C2=C(N=C1N3CCN(CC3)C)N(C(=O)NC2=O)C
CCC(n1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCN(CC1)C)C
InChI=1SC15H24N6O2c1510(2)211112(19(4)15(23)1713(11)22)1614(21)208618(3)7920h10H59H214H3(H172223)
MFCD01874850
ZINC000000237783
ZINC000000237785

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.