2-(1,3-benzodioxol-5-yl)-3-[3-(2-methylpropylamino)propyl]-1,3-thiazolidin-4-one,hydrochloride

Names

[ Name ]:
2-(1,3-benzodioxol-5-yl)-3-[3-(2-methylpropylamino)propyl]-1,3-thiazolidin-4-one,hydrochloride

[Synonym ]:
2-Benzo[1,3]dioxol-5-yl-3-(3-isobutylamino-propyl)-thiazolidin-4-on,Hydrochlorid
4-Thiazolidinone,3-(3-(isobutylamino)propyl)-2-(3,4-methylenedioxyphenyl)-,monohydrochloride
2-(1,3-benzodioxol-5-yl)-3-[3-(2-methylpropylamino)propyl]-1,3-thiazolidin-4-one hydrochloride
WIN 2661
2-benzo[1,3]dioxol-5-yl-3-(3-isobutylamino-propyl)-thiazolidin-4-one,hydrochloride
3-(3-(Isobutylamino)propyl)-2-(3,4-methylenedioxyphenyl)-4-thiazolidinone hydrochloride

Chemical & Physical Properties

[ Boiling Point ]:
517.5ºC at 760mmHg

[ Molecular Formula ]:
C₁₇H₂₅ClN₂O₃S

[ Molecular Weight ]:
372.91000

[ Flash Point ]:
266.8ºC

[ Exact Mass ]:
372.12700

[ PSA ]:
76.10000

[ LogP ]:
3.75580

[ Vapour Pressure ]:
8.15E-11mmHg at 25°C

Toxicological Information

CHEMICAL IDENTIFICATION

RTECS NUMBER :: XJ6277000

CHEMICAL NAME :: 4-Thiazolidinone, 3-(3-(isobutylamino)propyl)-2-(3,4-methylenedioxyphen yl)-, monohydrochloride

CAS REGISTRY NUMBER :: 102612-94-2

LAST UPDATED :: 198609

DATA ITEMS CITED :: 4

MOLECULAR FORMULA :: C17-H24-N2-O3-S.Cl-H

MOLECULAR WEIGHT :: 372.95

WISWESSER LINE NOTATION :: T56 BO DO CHJ H- ET5NV DSTJ A3M1Y1&1 &GH

HEALTH HAZARD DATA

ACUTE TOXICITY DATA

TYPE OF TEST :: Standard Draize test

ROUTE OF EXPOSURE :: Administration into the eye

SPECIES OBSERVED :: Rodent - rabbit

REFERENCE :: JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 40,132,1951 ** ACUTE TOXICITY DATA **

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

ROUTE OF EXPOSURE :: Subcutaneous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 320 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 40,132,1951

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - mouse

DOSE/DURATION :: 40 mg/kg

TOXIC EFFECTS :: Behavioral - convulsions or effect on seizure threshold Vascular - BP lowering not characterized in autonomic section Lungs, Thorax, or Respiration - other changes

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: 123,269,1958

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

ROUTE OF EXPOSURE :: Intravenous

SPECIES OBSERVED :: Rodent - guinea pig

DOSE/DURATION :: 20 mg/kg

TOXIC EFFECTS :: Details of toxic effects not reported other than lethal dose value

REFERENCE :: JAPMA8 Journal of the American Pharmaceutical Association, Scientific Edition. (Washington, DC) V.29-49, 1940-60. For publisher information, see JPMSAE. Volume(issue)/page/year: 40,132,1951

Related Compounds

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
(9H-fluoren-9-yl)methyl N-(4-hydroxy-3,3-dimethylbutyl)carbamate
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
3-methyl-N-[1-(6-oxo-4-phenyl-1,6-dihydropyrimidin-2-yl)-3-(thiophen-2-yl)-1H-pyrazol-5-yl]butanamide
N-(1-cyanocyclopentyl)-2-[4-(4-fluorobenzenesulfonyl)-1,4-diazepan-1-yl]acetamide
2-Amino-3-chloro-4,6-dimethoxybenzoic acid
4,5,6,7-Tetrahydrobenzo[d]isoxazole-3-carbaldehyde