Vitas-M small molecule compound

2-[({1-[2-(piperidinium-1-yl)ethyl]-1H-benzimidazol-2-yl}amino)methyl]phenolate

Catalog ID
STK568202
SMILES [O-]c1ccccc1CNc1nc2c(n1CC[NH+]1CCCCC1)cccc2

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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 C21H26N4O MW 350.46 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H26N4O/c26-20-11-5-2-8-17(20)16-22-21-23-18-9-3-4-10-19(18)25(21)15-14-24-12-6-1-7-13-24/h2-5,8-11,26H,1,6-7,12-16H2,(H,22,23)
InChIKey
VIGMYCZZSBRQGU-UHFFFAOYSA-N
Synonyms
797029-10-8
(O)c1ccccc1CNc1nc2c(n1CC(NH+)1CCCCC1)cccc2
2(((1(2(piperidinium1yl)ethyl)1Hbenzimidazol2yl)amino)methyl)phenolate
2(((1(2PIPERIDIN1IUM1YLETHYL)BENZIMIDAZOL2YL)AMINO)METHYL)PHENOLATE
2(((1(2PIPERIDIN1YLETHYL)BENZIMIDAZOL2YL)AMINO)METHYL)PHENOL
2((1(2PIPERIDIN1YLETHYL)1HBENZOIMIDAZOL2YLAMINO)METHYL)PHENOL
797029108
C1CC(NH+)(CC1)CCN2C3=CC=CC=C3N=C2NCC4=CC=CC=C4(O)
InChI=1SC21H26N4Oc26201152817(20)16222123189341019(18)25(21)151424126171324h2581126H1671216H2(H2223)
MFCD04009939
ZINC000000809665
ZINC809665

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Available files

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