Vitas-M small molecule compound

7-heptyl-3-methyl-8-(piperidin-1-yl)-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK546599
SMILES CCCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N1CCCCC1

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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 C18H29N5O2 MW 347.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H29N5O2/c1-3-4-5-6-10-13-23-14-15(21(2)18(25)20-16(14)24)19-17(23)22-11-8-7-9-12-22/h3-13H2,1-2H3,(H,20,24,25)
InChIKey
HHWFSLCLENXKAR-UHFFFAOYSA-N
Synonyms
106939-18-8
7heptyl3methyl8(piperidin1yl)1Hpurine26(3H7H)dione
7heptyl3methyl8(piperidin1yl)37dihydro1Hpurine26dione
CCCCCCCn1c(nc2c1c(=O)(nH)c(=O)n2C)N1CCCCC1
CCCCCCCN1C2=C(N=C1N3CCCCC3)N(C(=O)NC2=O)C
InChI=1SC18H29N5O2c134561013231415(21(2)18(25)2016(14)24)1917(23)22118791222h313H212H3(H202425)
MFCD00687839
ZINC000095897386

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Available files

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