Quinolinium, 1-butyl-6-(p-((1-butylquinolinium-6-yl)carbamoyl)cinnamamido)-, di-p-toluenesulfonate

Base Information

• Chemical Name: Quinolinium, 1-butyl-6-(p-((1-butylquinolinium-6-yl)carbamoyl)cinnamamido)-, di-p-toluenesulfonate
• CAS No.: 18520-38-2
• Molecular Formula: C50H52N4O8S2
• Molecular Weight: 901.0999
• ChEMBL ID: CHEMBL3230595
• Mol file: 18520-38-2.mol

Synonyms:Quinolinium, 6,6'-(styrene-alpha,p-diylbis(carbonylimino))bis(1-butyl-, ditosylate;6,6'-(Styrene-alpha,p-diylbis(carbonylimino))bis(1-butylquinolinium) ditosylate;Quinolinium, 1-butyl-6-(p-((1-butylquinolinium-6-yl)carbamoyl)cinnamamido)-, di-p-toluenesulfonate;18520-38-2;CHEMBL3230595;C36H38N4O2.2C7H7O3S;LS-142284;C36-H38-N4-O2.2C7-H7-O3-S

Chemical Property of Quinolinium, 1-butyl-6-(p-((1-butylquinolinium-6-yl)carbamoyl)cinnamamido)-, di-p-toluenesulfonate

Chemical Property:

• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 8
• Rotatable Bond Count: 11
• Exact Mass: 900.32265698
• Heavy Atom Count: 64
• Complexity: 1080

Purity/Quality:

Safty Information:

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MSDS Files:

Useful:

• Canonical SMILES: CCCC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)C=CC3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]
• Isomeric SMILES: CCCC[N+]1=CC=CC2=C1C=CC(=C2)NC(=O)/C=C/C3=CC=C(C=C3)C(=O)NC4=CC5=C(C=C4)[N+](=CC=C5)CCCC.CC1=CC=C(C=C1)S(=O)(=O)[O-].CC1=CC=C(C=C1)S(=O)(=O)[O-]

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