Vitas-M small molecule compound

1-{4-[(2,5-dihydroxyphenyl)sulfanyl]butyl}piperidinium

Catalog ID
STK370578
SMILES Oc1ccc(c(c1)SCCCC[NH+]1CCCCC1)O

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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 C15H24NO2S MW 282.43 g/mol Purity >90% as per NMR
InChI
InChI=1S/C15H23NO2S/c17-13-6-7-14(18)15(12-13)19-11-5-4-10-16-8-2-1-3-9-16/h6-7,12,17-18H,1-5,8-11H2/p+1
InChIKey
PIQRZMTWCXYOET-UHFFFAOYSA-O
Synonyms

1(4((25dihydroxyphenyl)sulfanyl)butyl)piperidinium
2(4PIPERIDIN1IUM1YLBUTYLSULFANYL)BENZENE14DIOL
C1CC(NH+)(CC1)CCCCSC2=C(C=CC(=C2)O)O
InChI=1SC15H23NO2Sc17136714(18)15(1213)19115410168213916h67121718H15811H2p+1
MFCD00433863
Oc1ccc(c(c1)SCCCC(NH+)1CCCCC1)O
ZINC000003156030
ZINC03156030

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Available files

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