Captodiame

CAS 486-17-9 MFCD00868016

化学结构图

486-17-9
SMILES: CCCCSc1ccc(C(SCCN(C)C)c2ccccc2)cc1

化学属性

Mol. FormulaC21H29NS2
Mol. Weight359.63

别名和识别编码

Chemical NameEthylamine,2-((p-(butylthio)-alpha-phenylbenzyl)thio)-N,N-dimethyl-
Wiswesser Line Notation4SR DYR&S2N1&1
Synonym 2-((p-(Butylthio)-alpha-phenylbenzyl)thio)-N,N-dimethylethylamine Captodiame Captodiamin Captodiamine Captodramin Captodramine Covatin Covatix Ethanamine, 2-(((4-(butylthio)phenyl)phenylmethyl)thio)-N,N-dimethyl- Kaptodiamin N 68 VUFB2350 captodiamine p-Butylmercaptobenzhydryl-beta-dimethylamino-ethylsulphide
CAS Number486-17-9
Beilstein Registry Number2625367
PubChem Substance ID10240
InChIInChI=1S/C21H29NS2/c1-4-5-16-23-20-13-11-19(12-14-20)21(24-17-15-22(2)3)18-9-7-6-8-10-18/h6-14,21H,4-5,15-17H2,1-3H3
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安全信息

RTECSKQ8563000
TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 3800 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 8,154,1958

TYPE OF TEST            : TDLo - Lowest published toxic dose
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Human
DOSE/DURATION           : 17 mg/kg
TOXIC EFFECTS :
   Behavioral - altered sleep time (including change in righting reflex)
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 8,154,1958

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Intraperitoneal
SPECIES OBSERVED        : Rodent - rat
DOSE/DURATION           : 343 mg/kg
TOXIC EFFECTS :
   Nutritional and Gross Metabolic - body temperature decrease
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960

TYPE OF TEST            : LD50 - Lethal dose, 50 percent kill
ROUTE OF EXPOSURE       : Oral
SPECIES OBSERVED        : Rodent - mouse
DOSE/DURATION           : 1630 mg/kg
TOXIC EFFECTS :
   Behavioral - convulsions or effect on seizure threshold
   Behavioral - somnolence (general depressed activity)
REFERENCE :
   ARZNAD Arzneimittel-Forschung. Drug Research.  (Editio Cantor Verlag,
   Postfach 1255, W-7960 Aulendorf, Fed. Rep. Ger.)  V.1-    1951-
   Volume(issue)/page/year: 8,154,1958

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