(1R,2S)-2-[3,3-di(thiophen-3-yl)prop-2-enylamino]-1-phenylpropan-1-ol,hydrochloride

Names

[ CAS No. ]:
50776-39-1

[ Name ]:
(1R,2S)-2-[3,3-di(thiophen-3-yl)prop-2-enylamino]-1-phenylpropan-1-ol,hydrochloride

[Synonym ]:
D-8955 hydrochloride
Tinofedrine hydrochloride
Novocebrin hydrochloride
Tinofedrine HCl

Chemical & Physical Properties

[ Molecular Formula ]:
C₂₀H₂₂ClNOS₂

[ Molecular Weight ]:
391.97800

[ Exact Mass ]:
391.08300

[ PSA ]:
88.74000

[ LogP ]:
6.14590

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: DO5464000

CHEMICAL NAME :: Benzyl alcohol, alpha-(1-((3,3-di-3-thienylallyl)amino)ethyl)-, hydrochloride, (+)-(alpha-R,S)-

CAS REGISTRY NUMBER :: 50776-39-1

LAST UPDATED :: 199109

DATA ITEMS CITED :: 6

MOLECULAR FORMULA :: C20-H21-N-O-S2.Cl-H

MOLECULAR WEIGHT :: 392.00

WISWESSER LINE NOTATION :: T5SJ CYU2MY1&YQR&- CT5SJ &GH

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 :: 6600 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: 4,286,1979

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - rat

DOSE/DURATION :: 14 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: 4,286,1979

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 1890 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: 4,286,1979

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 20150 ug/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: 4,286,1979

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Mammal - dog

DOSE/DURATION :: >5040 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: 4,286,1979

TYPE OF TEST :: LD50 - Lethal dose, 50 percent kill

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Mammal - dog

DOSE/DURATION :: 20 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: 4,286,1979

Related Compounds

3-[Amino(1,3-thiazol-2-yl)methyl]oxetan-3-ol
2-Cyclopropyl-1-[3-(2-hydroxypropan-2-yl)piperidin-1-yl]ethan-1-one
1-(4-Bromo-3-chlorophenyl)-2-chloroethan-1-ol
Tert-butyl 3-(3-amino-1-ethylpiperidin-3-yl)-3-hydroxypyrrolidine-1-carboxylate
1-(3-Aminothian-3-yl)-4,4-dimethylcycloheptan-1-ol
2-(Tert-butoxy)cyclobutan-1-amine
2-Amino-1-{8-bromo-[1,2,4]triazolo[4,3-a]pyrazin-3-yl}ethan-1-ol
2-[1-(Oxolane-3-carbonyl)piperidin-3-yl]propan-2-ol
5-cyclopropyl-1-(5-hydroxypentan-2-yl)-1H-1,2,3-triazole-4-carboxylic acid
1-(3-ethoxypropyl)-5-(1-methoxyethyl)-1H-1,2,3-triazole-4-carbaldehyde

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