Vitas-M small molecule compound

1-(2-{[(3,6-dichloropyridin-2-yl)carbonyl]amino}ethyl)-1-dodecylpiperidinium

Catalog ID
STK059065
SMILES CCCCCCCCCCCC[N+]1(CCCCC1)CCNC(=O)c1nc(Cl)ccc1Cl

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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 C25H42Cl2N3O MW 471.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H41Cl2N3O/c1-2-3-4-5-6-7-8-9-10-12-18-30(19-13-11-14-20-30)21-17-28-25(31)24-22(26)15-16-23(27)29-24/h15-16H,2-14,17-21H2,1H3/p+1
InChIKey
SQUAAOAOHYSTDH-UHFFFAOYSA-O
Synonyms

1(2(((36DICHLOROPYRIDIN2YL)CARBONYL)AMINO)ETHYL)1DODECYLPIPERIDINIUM
36DICHLORON(2(1DODECYLPIPERIDIN1IUM1YL)ETHYL)PYRIDINE2CARBOXAMIDE
CCCCCCCCCCCC(N+)1(CCCCC1)CCNC(=O)c1nc(Cl)ccc1Cl
CCCCCCCCCCCC(N+)1(CCCCC1)CCNC(=O)C2=C(C=CC(=N2)Cl)Cl
InChI=1SC25H41Cl2N3Oc12345678910121830(191311142030)21172825(31)2422(26)151623(27)2924h1516H2141721H21H3p+1
MFCD03032660
STK059065
ZINC000068576526
ZINC68576526

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Available files

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