Vitas-M small molecule compound

2,4-dibromo-6-{[(1-nonyl-1H-3,1-benzimidazol-3-ium-2-yl)amino]methyl}phenolate

Catalog ID
STK564669
SMILES CCCCCCCCCn1c(NCc2cc(Br)cc(c2[O-])Br)[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 C23H29Br2N3O MW 523.31 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H29Br2N3O/c1-2-3-4-5-6-7-10-13-28-21-12-9-8-11-20(21)27-23(28)26-16-17-14-18(24)15-19(25)22(17)29/h8-9,11-12,14-15,29H,2-7,10,13,16H2,1H3,(H,26,27)
InChIKey
RTMXINYGXZAFRQ-UHFFFAOYSA-N
Synonyms
383904-31-2
24dibromo6(((1nonyl1H31benzimidazol3ium2yl)amino)methyl)phenolate
383904312
CCCCCCCCCn1c(NCc2cc(Br)cc(c2(O))Br)(nH+)c2c1cccc2
MFCD03284019
ZINC000001773235

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Available files

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