Vitas-M small molecule compound

2-{[(1-butyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}-6-methoxyphenolate

Catalog ID
STL148323
SMILES CCCCn1c(NCc2cccc(c2[O-])OC)[nH+]c2c1cccc2

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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 C19H23N3O2 MW 325.41 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H23N3O2/c1-3-4-12-22-16-10-6-5-9-15(16)21-19(22)20-13-14-8-7-11-17(24-2)18(14)23/h5-11,23H,3-4,12-13H2,1-2H3,(H,20,21)
InChIKey
GFIAIAJKOHKFPX-UHFFFAOYSA-N
Synonyms
384794-32-5
2(((1butyl1H31benzimidazol3ium2yl)amino)methyl)6methoxyphenolate
384794325
CCCCn1c(NCc2cccc(c2(O))OC)(nH+)c2c1cccc2
MFCD02920598

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Available files

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