N-[4-[(1-ethylpyridin-5-yl)carbamoyl]phenyl]-N-(1-ethylquinolin-6-yl)benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate

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Names

[ CAS No. ]:
19060-33-4

[ Name ]:
N-[4-[(1-ethylpyridin-5-yl)carbamoyl]phenyl]-N-(1-ethylquinolin-6-yl)benzene-1,4-dicarboxamide; 4-methylbenzenesulfonate

Chemical & Physical Properties

[ Molecular Formula ]:
C40H38N5O6S+

[ Molecular Weight ]:
716.82500

[ Exact Mass ]:
716.25400

[ PSA ]:
160.64000

[ LogP ]:
7.41040

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VC3675800
CHEMICAL NAME :
Quinolinium, 1-ethyl-6-((p-(p-((1-ethylpyridinium-3-yl)carbamoyl)p henyl)carbamoyl) benzamido)-, di-p-toluenesulfonate
CAS REGISTRY NUMBER :
19060-33-4
LAST UPDATED :
199409
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C33-H31-N5-O3.2C7-H7-O3-S
MOLECULAR WEIGHT :
888.09
WISWESSER LINE NOTATION :
T66 BKJ B2 HMVR DVMR DVM- CT6KJ A2 &WSO&R D1 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD10 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
9 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value

MUTATION DATA

TYPE OF TEST :
DNA adduct
TEST SYSTEM :
Rodent - mouse Lymphocyte
DOSE/DURATION :
740 nmol/L
REFERENCE :
JMCMAR Journal of Medicinal Chemistry. (American Chemical Soc., Distribution Office Dept. 223, POB POB 57136, West End Stn., Washington, DC 20037) V.6- 1963- Volume(issue)/page/year: 22,134,1979

Related Compounds

  • 2-[(3-Fluorophenyl)amino]cyclopentanecarboxylic acid
  • 1'-Tert-butyl 4-methyl 4'-methyl-1,4'-bipiperidine-1',4-dicarboxylate
  • 5-Cyclopropoxy-2-iodo-3-(methylthio)pyridine
  • 5-(3-Methyl-1H-1,2,4-triazol-1-yl)pyrazine-2-carboxylic acid
  • 5-Cyclopropoxy-N,N-dimethyl-3-(methylthio)pyridin-2-amine
  • 2,5-dichloro-4-[(tetrahydro-2H-pyran-4-yl)methoxy]Pyrimidine
  • 1-Benzyl-2-methyl-1H-indol-3-yl imidothiocarbamate hydroiodide
  • 2-(5-Methyl-1H-1,2,4-triazol-1-yl)pyrimidine-5-carboxylic acid
  • N-(4-Cyclopropoxy-5-(methylamino)pyridin-3-YL)methanesulfonamide
  • 1-Tert-butoxy-3-cyclopropoxy-5-methoxybenzene
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