4-(2-Indol-1-ylethyl)-1-(3-(trimethylammonio)propyl)pyridinium dibromide

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Names

[ CAS No. ]:
21199-41-7

[ Name ]:
4-(2-Indol-1-ylethyl)-1-(3-(trimethylammonio)propyl)pyridinium dibromide

[Synonym ]:
4-(2-Indol-1-yl-aethyl)-1-(3-trimethylammonio-propyl)-pyridinium,Dibromid
4-(1H-imidazol-2-yl)phthalazin-1(2H)-one
4-(2-Imidazolyl)-phthalazone
4-(2-indol-1-yl-ethyl)-1-(3-trimethylammonio-propyl)-pyridinium,dibromide
4-(1H-imidazol-2-yl)-2H-phthalazin-1-one

Chemical & Physical Properties

[ Molecular Formula ]:
C21H29BrN3+

[ Molecular Weight ]:
403.37900

[ Exact Mass ]:
402.15400

[ PSA ]:
8.81000

[ LogP ]:
0.27180

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
UU5691650
CHEMICAL NAME :
Pyridinium, 4-(2-indol-1-ylethyl)-1-(3-(trimethylammonio)propyl)- , dibromide
CAS REGISTRY NUMBER :
21199-41-7
LAST UPDATED :
198608
DATA ITEMS CITED :
1
MOLECULAR FORMULA :
C21-H29-N3.2Br
MOLECULAR WEIGHT :
483.35

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intravenous
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
8500 ug/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
JPETAB Journal of Pharmacology and Experimental Therapeutics. (Williams & Wilkins Co., 428 E. Preston St., Baltimore, MD 21202) V.1- 1909/10- Volume(issue)/page/year: 120,438,1957

Safety Information

[ HS Code ]:
2933990090

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 3-(N,N,N-trimethylammonio)propyl bromide

DownStream

Customs

[ HS Code ]: 2933990090

[ Summary ]:
2933990090. heterocyclic compounds with nitrogen hetero-atom(s) only. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

Related Compounds

  • 1-(3-Tert-butylphenyl)-2,2-difluorocyclopropan-1-amine
  • Ethyl 8-hydroxy-6-oxo-1,3,4,6-tetrahydro-2H-quinolizine-4-carboxylate
  • (1S)-2,2,2-trifluoro-1-(2,3,4,5-tetrafluorophenyl)ethan-1-ol
  • 1-{2-[4-Fluoro-3-(trifluoromethyl)phenyl]ethyl}cyclopropan-1-ol
  • 4-((Cyclohexylamino)methyl)benzoic acid hydrochloride
  • 1-[(2,4-Dichlorophenyl)methyl]-N-(1,1-dimethylethyl)-2-methyl-1H-indole-3-methanamine
  • 2-Methoxy-6-(pyrazol-1-yl)-benzonitrile
  • [1-(4-Chloro-3-methylphenyl)-3-(methylsulfanyl)propan-2-yl](methyl)amine
  • 1H-3-Benzazepin-7-ol, 8-chloro-2,3,4,5-tetrahydro-5-(3-iodophenyl)-3-methyl-, (S)-
  • (4-Methyl-tetrahydro-furan-2-yl)-methanol