6-AMINO-1-ETHYL-4-(p-((p-((1-ETHYL PYRIDIN-IUM-4-YL)AMINO)PHENYL) CARBAMOYL) ANILINOQUINOLINIUM) DIBROMIDE

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Names

[ CAS No. ]:
42013-69-4

[ Name ]:
6-AMINO-1-ETHYL-4-(p-((p-((1-ETHYL PYRIDIN-IUM-4-YL)AMINO)PHENYL) CARBAMOYL) ANILINOQUINOLINIUM) DIBROMIDE

[Synonym ]:
Cain quinolinium

Chemical & Physical Properties

[ Molecular Formula ]:
C31H32BrN6O+

[ Molecular Weight ]:
584.52900

[ Exact Mass ]:
583.18200

[ PSA ]:
86.94000

[ LogP ]:
3.58050

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
VC3512400
CHEMICAL NAME :
Quinolinium, 6-amino-1-ethyl-4-(p-((p-((1-ethylpyridinium-4-yl)ami no)phenyl)carbamoyl) anilino)-, dibromide
CAS REGISTRY NUMBER :
42013-69-4
LAST UPDATED :
199409
DATA ITEMS CITED :
2
MOLECULAR FORMULA :
C31-H32-N6-O.2Br
MOLECULAR WEIGHT :
664.51
WISWESSER LINE NOTATION :
T66 BKJ B2 HZ EMR DVMR DM- DT6KJ A2 &E 2

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD10 - Lethal Dose
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
10 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 :
690 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

  • 4-(Anilinomethyl)pyridine-2-carbonitrile
  • 2-(4-Chloro-3-(2-(methylthio)ethoxy)phenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane
  • 2-[3-(Difluoromethoxy)phenyl]ethan-1-aminehydrochloride
  • 2-(2,5-Difluorophenyl)ethan-1-amine hydrochloride
  • 4-(Cyclobutylmethoxy)phenol
  • 5-Fluoro-4-methoxypyridin-3-ol
  • 7-((3S)-3-(((2S)-2-Aminopropanoyl)amino)pyrrolidin-1-yl)-1-cyclopropyl-6-fluoro-4-oxoquinoline-3-carboxylic acid
  • 2-Fluoro-3,4-dimethoxypyridine
  • (3-Chloro-5-(trifluoromethyl)phenyl)hydrazine hydrochloride(1:x)
  • (4aS,9bS)-2,8-dimethyl-1H,2H,3H,4H,4aH,5H,9bH-pyrido[4,3-b]indole dihydrochloride
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