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Substance Name: Quinolinium, 6,6'-((2-aminoterephthaloyl)diimino)bis(1-propyl-, di-p-toluenesulfonate
RN: 14170-93-5
InChIKey: RGLVKNOUKOWYDE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C32-H33-N5-O2.2C7-H7-O3-S

Molecular Weight

  • 862.036
 
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Names and Synonyms

Synonyms

  • 6,6'-((2-Aminoterephthaloyl)diimino)bis(1-propylquinolinium) di-p-toluenesulfonate
  • 6,6'-(2-Amino-1,4-phenylenebis(carbonylimino))bis(1-propylquinolinium) ditosylate

Systematic Name

  • Quinolinium, 6,6'-((2-aminoterephthaloyl)diimino)bis(1-propyl-, di-p-toluenesulfonate

Registry Numbers

CAS Registry Number

  • 14170-93-5

System Generated Number

  • 0014170935

Molecular Formulas

Molecular Formula

  • C32-H33-N5-O2.2C7-H7-O3-S

Molecular Formula Fragments

  • C32-H33-N5-O2
  • C7-H7-O3-S
  • COMPONENT

Structure Descriptors

InChI

1S/C32H31N5O2.2C7H8O3S/c1-3-15-36-17-5-7-22-9-12-25(20-29(22)36)34-31(38)24-11-14-27(28(33)19-24)32(39)35-26-13-10-23-8-6-18-37(16-4-2)30(23)21-26;2*1-6-2-4-7(5-3-6)11(8,9)10/h5-14,17-21H,3-4,15-16H2,1-2H3,(H2,33,39);2*2-5H,1H3,(H,8,9,10)

InChIKey

RGLVKNOUKOWYDE-UHFFFAOYSA-N

Smiles

c1(S(=O)(=O)[O-])ccc(C)cc1.Nc1cc(C(Nc2ccc3ccc[n+](CCC)c3c2)=O)ccc1C(Nc1ccc2ccc[n+](CCC)c2c1)=O.c1(ccc(cc1)C)S(=O)(=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD10 intraperitoneal 10mg/kg (10mg/kg)   Journal of Medicinal Chemistry. Vol. 22, Pg. 134, 1979.