(1R,8aR)-1-(4-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine,hydrobromide

Names

[ Name ]:
(1R,8aR)-1-(4-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine,hydrobromide

[Synonym ]:
(1R,8aR)-1-(4-methoxyphenyl)-1,5,6,7,8,8a-hexahydro-[1,3]oxazolo[3,4-a]pyridin-3-imine hydrobromide
3H-Oxazolo(3,4-a)pyridine,hexahydro-3-imino-1-(p-methoxyphenyl)-,hydrobromide (E)
trans-3-Imino-1-(p-methoxyphenyl)hexahydro-3H-oxazolo(3,4-a)pyridine hydrobromide

Chemical & Physical Properties

[ Molecular Formula ]:
C₁₄H₁₉BrN₂O₂

[ Molecular Weight ]:
327.21700

[ Exact Mass ]:
326.06300

[ PSA ]:
45.55000

[ LogP ]:
3.55150

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: RQ5833188

CHEMICAL NAME :: 3H-Oxazolo(3,4-a)pyridine, hexahydro-3-imino-1-(p-methoxyphenyl)-, hydrobromide (E)-

CAS REGISTRY NUMBER :: 5583-17-5

LAST UPDATED :: 199403

DATA ITEMS CITED :: 2

MOLECULAR FORMULA :: C14-H18-N2-O2.Br-H

MOLECULAR WEIGHT :: 327.26

WISWESSER LINE NOTATION :: T56 ANYOTJ BUM DR DO1 -T &EH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

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

ROUTE OF EXPOSURE :: Oral

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 300 mg/kg

TOXIC EFFECTS :: Brain and Coverings - recordings from specific areas of CNS Behavioral - excitement Vascular - BP elevation not characterized in autonomic section

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 15,111,1980

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 40 mg/kg

TOXIC EFFECTS :: Brain and Coverings - recordings from specific areas of CNS Behavioral - excitement Vascular - BP elevation not characterized in autonomic section

REFERENCE :: EJMCA5 European Journal of Medicinal Chemistry--Chimie Therapeutique. (Editions Scientifiques Elsevier, 29 rue Buffon, F-75005, Paris, France) V.9- 1974- Volume(issue)/page/year: 15,111,1980

Related Compounds

2-(1-Amino-2-hydroxyethyl)-4-bromo-6-methoxyphenol
2-Amino-2-(3-iodophenyl)ethan-1-ol
1-(3-Bromo-2-fluorophenyl)ethane-1,2-diamine
2-[4-(2-Methylpropyl)phenyl]pyrrolidine
4-Bromo-3-(pyrrolidin-2-yl)phenol
2-([(Tert-butoxy)carbonyl]amino)-5-(1,3-dioxolan-2-YL)pentanoic acid
1-(tert-Butoxycarbonyl)-3-(2-methylbenzyl)-2-piperidinecarboxylic acid
4-Oxo-2-(o-tolyl)cyclopentane-1-carboxylic acid
2-Fluoro-3-hydroxyprop-2-enal
3-(1-methyl-1H-imidazol-5-yl)benzaldehyde

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