4-(4-bromophenyl)-3-[(2-methyl-1H-indol-3-yl)methyl]-1H-1,2,4-triazole-5-thione

Names

[ CAS No. ]:
54649-04-6

[ Name ]:
4-(4-bromophenyl)-3-[(2-methyl-1H-indol-3-yl)methyl]-1H-1,2,4-triazole-5-thione

Chemical & Physical Properties

[ Density]:
1.57g/cm3

[ Boiling Point ]:
561.7ºC at 760 mmHg

[ Molecular Formula ]:
C18H15BrN4S

[ Molecular Weight ]:
399.30800

[ Flash Point ]:
293.5ºC

[ Exact Mass ]:
398.02000

[ PSA ]:
85.30000

[ LogP ]:
4.69900

[ Index of Refraction ]:
1.748

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
XZ5359010
CHEMICAL NAME :
3H-1,2,4-Triazole-3-thione, 2,4-dihydro-4-(4-bromophenyl)-5-((2-methyl-1H-indol-3 -yl) methyl)-
CAS REGISTRY NUMBER :
54649-04-6
LAST UPDATED :
198512
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C18-H15-Br-N4-S
MOLECULAR WEIGHT :
399.34

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
500 mg/kg
TOXIC EFFECTS :
Behavioral - altered sleep time (including change in righting reflex) Behavioral - ataxia Lungs, Thorax, or Respiration - respiratory depression
REFERENCE :
CNJPAZ Canadian Journal of Pharmaceutical Sciences. (Toronto, Ont., Canada) V.1-16, 1966-81. Discontinued. Volume(issue)/page/year: 9,108,1974

Related Compounds

  • 4-bromo-7-chloro-2,3-dihydro-6-Benzofurancarboxylic acid
  • rac-tert-butylN-[(1R,3R)-3-(2-aminoethyl)cyclopentyl]carbamate,cis
  • tert-Butyl (2S,3S)-3-(hydroxymethyl)-2-methylpyrrolidine-1-carboxylate
  • N-(2-(2-(1H-imidazol-1-yl)ethoxy)ethyl)-1-(4-fluorophenyl)cyclopropanecarboxamide
  • 2-(4-bromophenyl)-N-(2-(2-(2,5-dioxopyrrolidin-1-yl)ethoxy)ethyl)acetamide
  • N-[(5-cyclopropylpyridin-3-yl)methyl]-3-(3-methylthiophen-2-yl)propanamide
  • 5-bromo-N-[(5-cyclopropylpyridin-3-yl)methyl]furan-2-carboxamide
  • N-[(5-cyclopropylpyridin-3-yl)methyl]-5-methylthiophene-2-carboxamide
  • 1-Benzhydryl-3-((5-cyclopropylpyridin-3-yl)methyl)urea
  • 4-methyl-N-((3-(pyridin-4-yl)pyrazin-2-yl)methyl)-1,2,3-thiadiazole-5-carboxamide
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