ChemicalBook--->CAS DataBase List--->26615-21-4

26615-21-4

26615-21-4 Structure

26615-21-4 Structure
IdentificationBack Directory
[Name]

ZOTEPINE
[CAS]

26615-21-4
[Synonyms]

Setous
lodopin
zotepina
ZOTEPINE
Majorpin
f)thiepin,2-chloro-11-(2-(dimethylamino)ethoxy)-dibenzo(
8-Chloro-10-[2-(dimethylamino)ethoxy]dibenzo[b,f]thiepin
2-chlor-11-(2-dimethylaminoaethoxy)-dibenzo(b,f)-thiepin
2-chloro-11-(2-(dimethylamino)ethoxy)dibenzo(b,f)thiepin
2-chloro-11-(2-dimethylaminoethoxy)-dibenzo(b,f)thiepine
N,N-Dimethyl-2-(2-chlorodibenzo[b,f]thiepin-11-yloxy)ethylamine
2-(8-chlorobenzo[b][1]benzothiepin-6-yl)oxyethyl-dimethyl-amine
2-((8-chlorodibenzo(b,f)thiepin-10-yl)oxy)-n,n-dimethylethanamine
2-(8-chlorobenzo[b][1]benzothiepin-6-yl)oxy-N,N-dimethylethanamine
2-(8-chlorobenzo[b][1]benzothiepin-6-yl)oxy-N,N-dimethyl-ethanamine
2-[(8-Chlorodibenzo(Z)[b,f]thiepin-10-yl)oxy]-N,N-dimethylethanamine
Ethanamine, 2-[(8-chlorodibenzo[b,f]thiepin-10-yl)oxy]-N,N-dimethyl-
2-[(3-chloro-5-benzo[b][1]benzothiepinyl)oxy]-N,N-dimethylethanamine
[Molecular Formula]

C18H18ClNOS
[MDL Number]

MFCD00868143
[MOL File]

26615-21-4.mol
[Molecular Weight]

331.86
Chemical PropertiesBack Directory
[Melting point ]

90-91°
[Boiling point ]

478.4±45.0 °C(Predicted)
[density ]

1.0675 (rough estimate)
[refractive index ]

1.6100 (estimate)
[storage temp. ]

Store at RT
[solubility ]

DMSO: ≥20mg/mL
[form ]

powder
[pka]

8.72±0.28(Predicted)
[color ]

white to off-white
Safety DataBack Directory
[Hazard Codes ]

T
[Risk Statements ]

25-50/53
[Safety Statements ]

45-60-61
[RIDADR ]

UN 2811 6.1 / PGIII
[WGK Germany ]

3
[Toxicity]

LD50 in male mice, rats (mg/kg): 108, 458 orally; 43.3, 39.7 i.v.; 40.0, 97.0 i.p.; 84.9, 2080 s.c. (Fukuhara)
Hazard InformationBack Directory
[Chemical Properties]

White to off white crystalline powder
[Originator]

Lodopin,Fujisawa Pharmaceutical,Japan,1982
[Uses]

antipsychotic;Dopamine D2/serotonin 5-HT2 antagonist
[Definition]

ChEBI: Zotepine is a dibenzothiepine and a tertiary amino compound. It has a role as an alpha-adrenergic drug, a serotonergic drug and a second generation antipsychotic.
[Manufacturing Process]

A suspension of 30 g of sodium hydride in benzene (30 ml) was added dropwise to 52 g of 8-chlorodibenzo[b,f]thiepin-10(11H)-one dissolved in dimethylformamide (800 ml), and the mixture was heated at 100°C for 2 hours. To this, there were added 68 g of 2-dimethylaminoethyl chloride, and the mixture was heated at 60°C for 39 hours. The reaction mixture, after cooled, was poured into ice-water, and the solution was extracted with ethyl acetate. The ethyl acetate layer, after washed with water, was extracted with 10% hydrochloric acid, when oil was precipitated. The aqueous layer, in which oil was precipitated, was washed with ether, made neutral with concentrated sodium hydroxide solution and then extracted with ethyl acetate. The ethyl acetate layer was washed with water, dried over magnesium sulfate, and concentrated to give oil, which was allowed to stand to provide solid. The solid was washed with petroleum ether and recrystallized from cyclohexane to yield 42.5 g of 8-chloro-10-(2-dimethylaminoethyl)-oxydibenzo[b,f]thiepin as crystals, melting point 90°C to 91°C. Maleate as colorless needle, melting point 204°C to 204.5°C.
[Therapeutic Function]

Tranquilizer
Spectrum DetailBack Directory
[Spectrum Detail]

ZOTEPINE(26615-21-4)MS
ZOTEPINE(26615-21-4)1HNMR
ZOTEPINE(26615-21-4)IR1
ZOTEPINE(26615-21-4)IR2
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