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Trifluoperazine dihydrochloride

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Name

Trifluoperazine dihydrochloride

EINECS 207-123-0
CAS No. 440-17-5 Density N/A
PSA 35.02000 LogP 6.49040
Solubility N/A Melting Point 243 °C (dec.)(lit.)
Formula C21H26Cl2F3N3S Boiling Point 506 °C at 760 mmHg
Molecular Weight 480.425 Flash Point 259.8 °C
Transport Information N/A Appearance Cream fine powder
Safety 36 Risk Codes 22
Molecular Structure Molecular Structure of 440-17-5 (Trifluoperazine dihydrochloride) Hazard Symbols HarmfulXn
Synonyms

10H-Phenothiazine,10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)-, dihydrochloride(9CI);Phenothiazine,10-[3-(4-methyl-1-piperazinyl)propyl]-2-(trifluoromethyl)-, dihydrochloride(6CI,8CI);2-Trifluoromethyl-10-[3-(1-methyl-4-piperazinyl)propyl]phenothiazinedihydrochloride;2-Trifluoromethyl-10-[3'-(1-methyl-4-piperazinyl)propyl]phenothiazinedihydrochloride;Eskazine;Eskazinyl;Fluoperazine;Jatroneural;Modalina;SKF5019;Stelazine;Terfluzine;Trazine;Trifluoperazine dihydrochloride;Trifluoperazine hydrochloride;Trifluoroperazine dihydrochloride;Trifluoroperazine hydrochloride;Triftazin;Triphthasine;Triphthazine;Triphthazine dihydrochloride;Tryptazine;Tryptazine dihydrochloride;

 

Trifluoperazine dihydrochloride Specification

The Trifluperazine dihydrochloride, with the CAS registry number 440-17-5, is also known as 2-Trifluoromethyl-10-(3'-(1-methyl-4-piperazinyl)propyl)phenothiazine dihydrochloride. It belongs to the product categories of Organics; Intermediates & Fine Chemicals; Pharmaceuticals. Its EINECS registry number is 207-123-0. This chemical's molecular formula is C21H26Cl2F3N3S and molecular weight is 480.41745. Its IUPAC name is called 10-[3-(4-methylpiperazin-1-yl)propyl]-2-(trifluoromethyl)phenothiazine dihydrochloride. This chemical's classification codes are Antipsychotic; Drug / Therapeutic Agent; Human Data; Mutation Data; Reproductive Effect; Sedative-hypnotic. What's more, Trifluperazine dihydrochloride is used for the treatment with paranoid schizophrenia, chronic schizophrenia, mental anxiety, emotional disorders, nausea, vomiting, etc.

Physical properties of Trifluperazine dihydrochloride: (1)ACD/LogP: 5.108; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): 2.66; (4)ACD/LogD (pH 7.4): 4.38; (5)ACD/BCF (pH 5.5): 16.13; (6)ACD/BCF (pH 7.4): 835.19; (7)ACD/KOC (pH 5.5): 51.43; (8)ACD/KOC (pH 7.4): 2663.08; (9)#H bond acceptors: 3; (10)#Freely Rotating Bonds: 4; (11)Flash Point: 259.8 °C; (12)Enthalpy of Vaporization: 77.58 kJ/mol; (13)Boiling Point: 506 °C at 760 mmHg; (14)Vapour Pressure: 2.32E-10 mmHg at 25°C

When you are using this chemical, please be cautious about it as the following:
This chemical may cause damage to health. It is harmful if swallowed. Whenever you will contact it, please wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CN1CCN(CC1)CCCN2C3=CC=CC=C3SC4=C2C=C(C=C4)C(F)(F)F.Cl.Cl
(2)InChI: InChI=1S/C21H24F3N3S.2ClH/c1-25-11-13-26(14-12-25)9-4-10-27-17-5-2-3-6-19(17)28-20-8-7-16(15-18(20)27)21(22,23)24;;/h2-3,5-8,15H,4,9-14H2,1H3;2*1H
(3)InChIKey: BXDAOUXDMHXPDI-UHFFFAOYSA-N

The toxicity data is as follows:

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
man TDLo oral 1143ug/kg/1D- (1.143mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: ATAXIA

BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY)
British Journal of Clinical Practice. Vol. 28, Pg. 201, 1974.
monkey LDLo oral > 20mg/kg (20mg/kg) BEHAVIORAL: REGIDITY

BEHAVIORAL: MUSCLE WEAKNESS

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 122, Pg. 129, 1959.
mouse LD50 intraperitoneal 133mg/kg (133mg/kg)   Farmakologiya i Toksikologiya Vol. 41, Pg. 680, 1978.
mouse LD50 intravenous 82mg/kg (82mg/kg)   Acta Pharmacologica et Toxicologica. Vol. 19, Pg. 87, 1962.
mouse LD50 oral 424mg/kg (424mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 27, Pg. 866, 1977.
rabbit LD50 intravenous 65mg/kg (65mg/kg)   British Journal of Pharmacology and Chemotherapy. Vol. 25, Pg. 158, 1965.
rat LD50 oral 543mg/kg (543mg/kg)   Arzneimittel-Forschung. Drug Research. Vol. 27, Pg. 866, 1977.

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