Tibezonium iodide

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Names

[ CAS No. ]:
54663-47-7

[ Name ]:
Tibezonium iodide

[Synonym ]:
tibezonium iodide
tibenzonium iodide
Antoral
Ethanaminium,N,N-diethyl-N-methyl-2-[[4-[4-(phenylthio)phenyl]-3H-1,5-benzodiazepin-2-yl]thio]-,iodide
Tibezonium
N,N-Diethyl-N-methyl-2-[[4-[4-(phenylthio)phenyl]-3H-1,5-benzodiazepin-2-yl]thio]ethanaminium iodide
Rec 15-0691
Thiabenzazonium
2-(Methyl-diaethylammonium-aethylthio)-4-(p-phenyl-thio-phenyl)-3H-1,5-benzodiazepin-jodid
Tibezonium-jodid

Chemical & Physical Properties

[ Melting Point ]:
162ºC

[ Molecular Formula ]:
C28H32IN3S2

[ Molecular Weight ]:
601.60800

[ Exact Mass ]:
601.10800

[ PSA ]:
75.32000

[ LogP ]:
3.48710

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :
KH2770000
CHEMICAL NAME :
Ethanaminium, N,N-diethyl-N-methyl-2-((4-(4-(phenylthio)phenyl)- 3H-1,5-benzodiazepin-2-yl) thio)-, iodide
CAS REGISTRY NUMBER :
54663-47-7
LAST UPDATED :
199206
DATA ITEMS CITED :
4
MOLECULAR FORMULA :
C28-H32-N3-S2.I
MOLECULAR WEIGHT :
601.65
WISWESSER LINE NOTATION :
T67 GN KN IHJ HS2K2&2&2 JR DSR &I

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
>10 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EXPEAM Experientia. (Birkhaeuser Verlag, POB 133, CH-4010 Basel, Switzerland) V.1- 1945- Volume(issue)/page/year: 31,440,1975
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - rat
DOSE/DURATION :
35 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
DRFUD4 Drugs of the Future. (J.R. Prous, S.A., Apartado de Correos 540, 08080 Barcelona, Spain) V.1- 1975/76- Volume(issue)/page/year: 3,152,1978
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Oral
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
9 gm/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EXPEAM Experientia. (Birkhaeuser Verlag, POB 133, CH-4010 Basel, Switzerland) V.1- 1945- Volume(issue)/page/year: 31,440,1975
TYPE OF TEST :
LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE :
Intraperitoneal
SPECIES OBSERVED :
Rodent - mouse
DOSE/DURATION :
42 mg/kg
TOXIC EFFECTS :
Details of toxic effects not reported other than lethal dose value
REFERENCE :
EXPEAM Experientia. (Birkhaeuser Verlag, POB 133, CH-4010 Basel, Switzerland) V.1- 1945- Volume(issue)/page/year: 31,440,1975

Related Compounds

  • Tibezonium iodide
  • Magnoflorine Iodide
  • tetraethylarsanium,iodide
  • hafnium iodide
  • pentylmagnesium iodide
  • Pentaiodide
  • 3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-[(5-methyl-1,3,4-thiadiazol-2-yl)carbamoyl]propanoic acid
  • (2R)-2-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)butanamido]-4-(methylsulfanyl)butanoic acid
  • 3-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(methylsulfanyl)butanamido]-2-methylpropanoic acid
  • 3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-3-[(2-hydroxy-3-methylbutyl)carbamoyl]propanoic acid
  • (2R)-2-[3-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylpropanamido]-4-(methylsulfanyl)butanoic acid
  • 1-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(methylsulfanyl)butanoyl]azetidine-3-carboxylic acid
  • 1-[(2R)-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-methylpentanamido]cyclopropane-1-carboxylic acid
  • 2-[N-cyclopropyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-2-methylpentanamido]acetic acid
  • 2-[(2S)-N-cyclopropyl-2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)-4-(methylsulfanyl)butanamido]acetic acid
  • 5-chloro-2-[2-({[(9H-fluoren-9-yl)methoxy]carbonyl}amino)propanamido]benzoic acid
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