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チオリダジン塩酸塩

Thioridazine Hydrochloride

HCID 66062
ノート反応
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
部分構造検索類似構造を探す

基本情報

CAS
130-61-0
標準SMILES
CSc1ccc2c(c1)N(CCC1CCCCN1C)c1ccccc1S2.Cl
InChIKey
NZFNXWQNBYZDAQ-UHFFFAOYSA-N
分子式
C21H27ClN2S2
平均分子量
407 g/mol
単同位体質量
406.1304189

概要

Thioridazine hydrochloride is a hydrochloride. It has a role as a geroprotector and a first generation antipsychotic. It contains a thioridazine.

名称と識別子

優先名称
Thioridazine Hydrochloride
IUPAC
10-[2-(1-methylpiperidin-2-yl)ethyl]-2-methylsulfanylphenothiazine;hydrochloride
現地名
チオリダジン塩酸塩
英語名
Thioridazine hydrochloride
分子式
C21H27ClN2S2
分子量
407.04

名称と別名

Thioridazine hydrochloride130-61-0Thioridazine HclSonapax hydrochlorideMellaril hydrochlorideRidazineDTXSID90494014WCI67NK8MNSC-186060Thioridazine hydrochloride intensol2-Methylmercapto-10-(2-(N-methyl-2-piperidyl)ethyl)phenothiazine hydrochlorideDTXCID3029360
名称をさらに表示
アルダジンノボリダジンリダジン塩酸チオリダジンスタレリルメラリル塩酸塩マロロールオルサニルメレリル【錠剤】チオリダジン·塩酸塩チオリダジンクロリダートチオリダジン塩酸塩10-[2-(1-メチルピペリジン-2-イル)エチル]-2-(メチルチオ)-10H-フェノチアジン·塩酸塩10-[2-(1-メチルピペリジン-2-イル)エチル]-2-(メチルチオ)-10H-フェノチアジン塩酸塩THIOリダジンE HCLチオリダジン 塩酸塩チオリダジン塩酸塩 (JP17)10-[2-(1-メチルピペリジン-2-イル)エチル]-2-(メチルチオ)-10H-フェノチアジン・塩酸塩チオリダジン・塩酸塩L-714RidazinOrsanilusafsz-3

物性

構造計算による物性

極性表面積
57.1 Ų
水素結合供与体数
1
水素結合受容体数
4
回転可能結合数
4
重原子数
26
形式電荷
0
複雑度
432

実験および物理化学的性質

Human Drugs · 2 件

FDA approved drugs -> Active ingredient

FDA approved drugs -> Active ingredient

Collision Cross Section185 Ų [M+H]+ [CCS Type: TW; Method: calibrated with polyalanine and drug standards]

物理化学的性質

融点
158 · 158-1600C
沸点
230 °C · 230°C (rough estimate)
比重(密度)
1.1227 · 1.1227 (rough estimate)
屈折率
1.561 · 1.5610 (estimate)
貯蔵温度
2 · 2-8°C
溶解性
2 O: · H2O: 可溶250 mg プラス 5 ml の溶媒、透明、無色から微黄色
外見
オフホワイトの無地
色
White to Almost white
水溶解度
水 (75 mM)、DMSO (100 mM)、クロロホルム、エタノール、メタノールに可溶。
Merck
14 · 14,9359
InChI
1S/C21H26N2S2.ClH/c1-22-13-6-5-7-16(22)12-14-23-18-8-3-4-9-20(18)25-21-11-10-17(24-2)15-19(21)23;/h3-4,8-11,15-16H,5-7,12-14H2,1-2H3;1H
InChIKey
NZFNXWQNBYZDAQ-UHFFFAOYSA-N
SMILES
Cl.CSc1ccc2Sc3ccccc3N(CCC4CCCCN4C)c2c1

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 4 件

Warning

H302 (98%): Harmful if swallowed [Warning Acute toxicity, oral]

P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 49 reports by companies from 11 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information10H-Phenothiazine, 10-2-(1-methyl-2-piperidinyl)ethyl-2-(methylthio)-, monohydrochloride: Does not have an individual approval but may be used under an appropriate group standard
Other Safety InformationIMAP assessments - 10H-Phenothiazine, 10-[2-(1-methyl-2-piperidinyl)ethyl]-2-(methylthio)-, monohydrochloride: Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (98%)

毒性情報

Treatment · 1 件

An airway must be established and maintained. Adequate oxygenation and ventilation must be ensured. Cardiovascular monitoring should commence immediately and should include continuous electrocardiographic monitoring to detect possible arrhythmias. Treatment may include one or more of the following therapeutic interventions: correction of electrolyte abnormalities and acid-base balance, lidocaine, phenytoin, isoproterenol, ventricular pacing, and defibrillation. Disopyramide, procainamide, and quinidine may produce additive QT-prolonging effects when administered to patients with acute overdosage of Mellaril and should be avoided. Caution must be exercised when administering lidocaine, as it may increase the risk of developing seizures. Treatment of hypotension may require intravenous fluids and vasopressors. Phenylephrine, levarterenol, or metaraminol are the appropriate pressor agents for use in the management of refractory hypotension. Gastric lavage and repeated doses of activated charcoal should be considered. Induction of emesis is less preferable to gastric lavage because of the risk of dystonia and the potential for aspiration of vomitus. Acute extrapyramidal symptoms may be treated with diphenhydramine hydrochloride or benztropine mesylate. Forced diuresis, hemoperfusion, hemodialysis and manipulation of urine pH are of unlikely benefit in the treatment of phenothiazine overdose due to their large volume of distribution and extensive plasma protein binding. (L1712)

化学と産業

薬理情報

Metabolism/MetabolitesHepatic Half Life: 21-25 hours
FDA Pharmacological Classification · 2 件

THIORIDAZINE HYDROCHLORIDE

Phenothiazines [CS]; Phenothiazine [EPC]

MeSH Pharmacological Classification · 2 件

Agents that control agitated psychotic behavior, alleviate acute psychotic states, reduce psychotic symptoms, and exert a quieting effect. They are used in SCHIZOPHRENIA; senile dementia; transient psychosis following surgery; or MYOCARDIAL INFARCTION; etc. These drugs are often referred to as neuroleptics alluding to the tendency to produce neurological side effects, but not all antipsychotics are likely to produce such effects. Many of these drugs may also be effective against nausea, emesis, and pruritus.

Drugs that bind to but do not activate DOPAMINE RECEPTORS, thereby blocking the actions of dopamine or exogenous agonists. Many drugs used in the treatment of psychotic disorders (ANTIPSYCHOTIC AGENTS) are dopamine antagonists, although their therapeutic effects may be due to long-term adjustments of the brain rather than to the acute effects of blocking dopamine receptors. Dopamine antagonists have been used for several other clinical purposes including as ANTIEMETICS, in the treatment of Tourette syndrome, and for hiccup. Dopamine receptor blockade is associated with NEUROLEPTIC MALIGNANT SYNDROME.

用途と製造

UsesFor the treatment of schizophrenia and generalized anxiety disorder.
応用分野 · 2 件

使用Thioridazine hydrochloride has been used as an intercalating agent for analyzing the integrity of double-stranded DNA (dsDNA) using square-wave voltammetry (SWV) techniques. Thioridazine hydrochloride has also been used as a positive control for the inhibition of hepatic enzyme cytochrome P4502D6 (CYP2D6) in human liver microsomes.

Thioridazine hydrochloride,10-[2-(1-methyl-2-piperidyl)ethyl]-2-(methylthio)phenothiazine monohydrochloride (Mellaril), is amember of the piperidine subgroup of the phenothiazines.The drug has a relatively low tendency to produce EPS. Thedrug has high anticholinergic activity, and this activity in thestriatum, counterbalancing a striatal DA block, may be responsiblefor the low EPS. It also has been suggested thatthere may be increased DA receptor selectivity, which may be responsible. The drug has sedative and hypotensive activityin common with chlorpromazine and less antiemeticactivity. At high doses, pigmentary retinopathy has been observed.Its major metabolites include N-demethylated, ringhydroxylated,and S-oxidized products. Thioridazine isprominently converted to the active metabolite mesoridazine(discussed next), which probably contributes to the antipsychoticactivity of thioridazine.

関連反応

0 件
反応記録を作成

現在のフィルター条件では反応記録がありません。

化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
USAF SZ-B
Stalleril
NSC 186060
Novoridazine
465 (Maleate)
CHEBI:48566NSC1860602-Methylmercapto-10-[2-(N-methyl-2-piperidyl)ethyl]phenothiazine hydrochlorideRefChem:5661210-(2-((2RS)-1-Methylpiperidin-2-yl)ethyl)-2-methylsulfanyl-10H-phenothiazine monohydrochloride204-992-8Thioridazine.HClThioridazine chloride

データベース識別子

CAS
130-61-0
PubChem CID
66062
DTXSID
DTXSID9049401
ChEMBL
CHEMBL1200916
ChEBI
CHEBI:48566
UNII
4WCI67NK8M
EC Number
204-992-8
CAS データベース
130 · 130-61-0(CAS DataBase Reference)
NISTの化学物質情報
Thioridazine hydrochloride(130-61-0)
EPAの化学物質情報
10 H-Phenothiazine, · 10H-Phenothiazine, 10-[2-(1-methyl-2-piperidinyl)ethyl]-2-(methylthio)-, monohydrochloride (130-61-0)

化学的性質

化学的特性Pale Yellow Solid

Exposure RoutesOral
Toxicity Summary · 1 件

Thioridazine blocks postsynaptic mesolimbic dopaminergic D1 and D2 receptors in the brain; blocks alpha-adrenergic effect, depresses the release of hypothalamic and hypophyseal hormones and is believed to depress the reticular activating system thus affecting basal metabolism, body temperature, wakefulness, vasomotor tone, and emesis.

Signs and Symptoms · 1 件

LD<sub>50</sub>=956-1034 mg/kg (Orally in rats); Agitation, blurred vision, coma, confusion, constipation, difficulty breathing, dilated or constricted pupils, diminished flow of urine, dry mouth, dry skin, excessively high or low body temperature, extremely low blood pressure, fluid in the lungs, heart abnormalities, inability to urinate, intestinal blockage, nasal congestion, restlessness, sedation, seizures, shock

Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).
Drug Induced Liver Injury · 6 件

Drug Induced Liver Injury Rank (DILIrank 2.0)

Thioridazine hydrochloride

vLess-DILI-concern

5

Adverse reactions

DOI:10.1016/j.drudis.2016.02.015

Toxicity DataLD<sub>50</sub>=956-1034 mg/kg (Orally in rats).

安全データ

wgk
3
rtecs
SP2275000
ridadr
UN 3077 9/PG 3
hs_code
2934302300
risk_code
22-36/37/38-50/53
hazard_code
Xn,N
safety_code
26-36-60-61
hazard_class
9
Hazard Classifications
Acute Tox. 4 Oral
ストレージクラス
11 - Combustible Solids
一般的な説明

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