Vitas-M small molecule compound

8-[bis(2-hydroxyethyl)amino]-7-hexyl-3-methyl-3,7-dihydro-1H-purine-2,6-dione

Catalog ID
STK529421
SMILES CCCCCCn1c(nc2c1c(=O)[nH]c(=O)n2C)N(CCO)CCO

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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 C16H27N5O4 MW 353.42 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H27N5O4/c1-3-4-5-6-7-21-12-13(19(2)16(25)18-14(12)24)17-15(21)20(8-10-22)9-11-23/h22-23H,3-11H2,1-2H3,(H,18,24,25)
InChIKey
FAEQPBIBOXUMAV-UHFFFAOYSA-N
Synonyms
368434-29-1
368434291
8(bis(2hydroxyethyl)amino)7hexyl3methyl1Hpurine26(3H7H)dione
8(bis(2hydroxyethyl)amino)7hexyl3methyl37dihydro1Hpurine26dione
8(BIS(2HYDROXYETHYL)AMINO)7HEXYL3METHYLPURINE26DIONE
CCCCCCn1c(nc2c1c(=O)(nH)c(=O)n2C)N(CCO)CCO
CCCCCCN1C2=C(N=C1N(CCO)CCO)N(C(=O)NC2=O)C
InChI=1SC16H27N5O4c134567211213(19(2)16(25)1814(12)24)1715(21)20(81022)91123h2223H311H212H3(H182425)
MFCD01552826
ZINC000013511546
ZINC13511546

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Available files

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