Vitas-M small molecule compound

1-(3-chloropropyl)-3-(quinolin-2-yl)quinolinium

Catalog ID
STK380625
SMILES ClCCC[n+]1cc(cc2c1cccc2)c1ccc2c(n1)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 C21H18ClN2 MW 333.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H18ClN2/c22-12-5-13-24-15-18(14-17-7-2-4-9-21(17)24)20-11-10-16-6-1-3-8-19(16)23-20/h1-4,6-11,14-15H,5,12-13H2/q+1
InChIKey
AMLSJJFWOWBAIK-UHFFFAOYSA-N
Synonyms

1(3chloropropyl)3(quinolin2yl)quinolinium
1(3CHLOROPROPYL)3QUINOLIN2YLQUINOLIN1IUM
1(3CHLOROPROPYL)3QUINOLIN2YLQUINOLINIUM
C1=CC=C2C(=C1)C=CC(=N2)C3=CC4=CC=CC=C4(N+)(=C3)CCCCl
ClCCC(n+)1cc(cc2c1cccc2)c1ccc2c(n1)cccc2
InChI=1SC21H18ClN2c2212513241518(1417724921(17)24)20111016613819(16)2320h146111415H51213H2q+1
MFCD02067715
ZINC000004081516
ZINC04081516
ZINC4081516

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Available files

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