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ブプロピオン臭化水素酸塩

Bupropion Hydrobromide

HCID 11984562
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
905818-69-1
標準SMILES
Br.CC(NC(C)(C)C)C(=O)c1cccc(Cl)c1
InChIKey
WSTCENNATOVXKQ-UHFFFAOYSA-N
分子式
C13H19BrClNO
平均分子量
320.65 g/mol
単同位体質量
319.03385401

概要

Bupropion Hydrobromide is the hydrobromide salt of an aminoketone with antidepressant activity. The molecular mechanism of the antidepressant effect of bupropion is unknown. This agent does not inhibit monoamine oxidase and, compared to classical tricyclic antidepressants, is a weak blocker of the neuronal uptake of serotonin and norepinephrine. Buproprion also weakly inhibits the neuronal re-uptake of dopamine.

名称と識別子

優先名称
Bupropion Hydrobromide
IUPAC
2-(tert-butylamino)-1-(3-chlorophenyl)propan-1-one;hydrobromide
現地名
ブプロピオン臭化水素酸塩
英語名
Bupropion HydrobroMide
分子式
C13H19BrClNO
分子量
320.65306

名称と別名

Bupropion hydrobromide905818-69-1Aplenzinbupropion HBrAplenzin ERUNII-E70G3G5863BVF-033E70G3G5863BUPROPION HYDROBROMIDE (MART.)BUPROPION HYDROBROMIDE [MART.]BUPROPION HYDROBROMIDE (USP-RS)BUPROPION HYDROBROMIDE [USP-RS]
名称をさらに表示
ブプロピオン臭化水素酸塩Bupropion Impurity 43Amfebutamone hydrobromideBupropion Hydrobromide (1078846)2-(tert-Butylamino)-1-(3-chlorophenyl)propan-1-one hydrobromide
(2RS)-1-(3-CHLOROPHENYL)-2-((1,1-DIMETHYLETHYL)AMINO)PROPAN-1-ONE HBR1-PROPANONE, 1-(3-CHLOROPHENYL)-2-((1,1-DIMETHYLETHYL)AMINO)-, HBR (1:1)(2RS)-1-(3-CHLOROPHENYL)-2-((1,1-DIMETHYLETHYL)AMINO)PROPAN-1-ONE HYDROBROMIDE(2RS)-1-(3-Chlorophenyl)-2-[(1,1-dimethylethyl)amino]propan-1-one hydrobromide1-PROPANONE, 1-(3-CHLOROPHENYL)-2-((1,1-DIMETHYLETHYL)AMINO)-, HYDROBROMIDE (1:1)1-Propanone, 1-(3-chlorophenyl)-2-[(1,1-dimethylethyl)amino]-, hydrobromide (1:1)APLENZINERRefChem:54575

データベース識別子

CAS
905818-69-1
PubChem CID
11984562

物性

構造計算による物性

極性表面積
29.1 Ų
水素結合供与体数
2
水素結合受容体数
2
回転可能結合数
4
重原子数
17
形式電荷
0
複雑度
247

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

物理化学的性質

貯蔵温度
2 · 2-30°C
主な用途
医薬品
InChI
1S/C13H18ClNO.BrH/c1-9(15-13(2,3)4)12(16)10-6-5-7-11(14)8-10;/h5-9,15H,1-4H3;1H
InChIKey
WSTCENNATOVXKQ-UHFFFAOYSA-N
SMILES
[Br-].Clc1cc(ccc1)C(=O)C([N+H2]C(C)(C)C)C

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 (100%): Harmful if swallowed [Warning Acute toxicity, oral]

P264, P270, P301+P317, P330, and P501 (click each P-code to see the statement)

The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)

毒性情報

Treatment · 1 件

Ensure an adequate airway, oxygenation, and ventilation. Monitor cardiac rhythm and vital signs. EEG monitoring is also recommended for the first 48 hours post-ingestion. General supportive and symptomatic measures are also recommended. Induction of emesis is not recommended. Activated charcoal should be administered. There is no experience with the use of forced diuresis, dialysis, hemoperfusion, or exchange transfusion in the management of bupropion overdoses. No specific antidotes for bupropion are known. Due to the dose-related risk of seizures with Bupropion, hospitalization following suspected overdose should be considered. Based on studies in animals, it is recommended that seizures be treated with intravenous benzodiazepine administration and other supportive measures, as appropriate. (L1712)

Exposure RoutesFor sustained release, peak plasma concentrations are achieved within 3 hours.
Toxicity Summary · 1 件

Bupropion selectively inhibits the neuronal reuptake of dopamine, norepinephrine, and serotonin; actions on dopaminergic systems are more significant than imipramine or amitriptyline whereas the blockade of norepinephrine and serotonin reuptake at the neuronal membrane is weaker for bupropion than for tricyclic antidepressants. The increase in norepinephrine may attenuate nicotine withdrawal symptoms and the increase in dopamine at neuronal sites may reduce nicotine cravings and the urge to smoke. Bupropion exhibits moderate anticholinergic effects.

化学と産業

薬理情報

Metabolism/Metabolites · 1 件

Reduction of the carbonyl groupand/or hydroxylation of the tert-butyl group of bupropion. Route of Elimination: Bupropion is extensively metabolized in humans. Oxidation of the bupropion side chain results in the formation of a glycine conjugate of metachlorobenzoic acid, which is then excreted as the major urinary metabolite. Following oral administration of 200 mg of 14C-bupropion in humans, 87% and 10% of the radioactive dose were recovered in the urine and feces, respectively. However, the fraction of the oral dose of bupropion excreted unchanged was only 0.5%, a finding consistent with the extensive metabolism of bupropion. Half Life: 24 hours

FDA Pharmacological Classification · 2 件

BUPROPION HYDROBROMIDE

Increased Norepinephrine Activity [PE]; Increased Dopamine Activity [PE]; Norepinephrine Uptake Inhibitors [MoA]; Dopamine Uptake Inhibitors [MoA]; Aminoketone [EPC]

用途と製造

UsesFor the treatment of depression and as aid to smoking cessation.

サプライヤー17 社

杭州摩库生物医药科技有限公司+86-057181025280; +8617767106207 · [email protected]
陕西缔都化学有限公司029-029-81123119 17391733320 · [email protected]
Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]
上海柯维化学技术有限公司021-64609169 18901607656 · [email protected]
佛山宝诺生物科技有限公司0757-85921206 18520245316 · [email protected]

関連反応

33 件
反応記録を作成
HRID 229562 の反応式
HRID 229562生成物としてuspto-grants-2009_07
HRID 229564 の反応式
HRID 229564反応物としてuspto-grants-2009_07
HRID 732160 の反応式
HRID 732160生成物としてuspto-grants-2009_09
HRID 732162 の反応式
HRID 732162反応物としてuspto-grants-2009_09
HRID 1295210 の反応式
HRID 1295210生成物としてuspto-grants-2007_07
HRID 1295212 の反応式
HRID 1295212反応物としてuspto-grants-2007_07
HRID 1363422 の反応式
HRID 1363422生成物としてuspto-grants-2011_02
HRID 1363424 の反応式
HRID 1363424反応物としてuspto-grants-2011_02
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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
DTXSID
DTXSID20920317
ChEMBL
CHEMBL1201735
UNII
E70G3G5863
EC Number
111-003-2
Signs and SymptomsSymptoms of overdose include seizures, hallucinations, loss of consciousness, tachycardia, and cardiac arrest.
Carcinogen ClassificationNo indication of carcinogenicity to humans (not listed by IARC).

安全データ

wgk
WGK 3
hs_code
2923900100
Hazard Classifications
Acute Tox. 4 Oral
ストレージクラス
11 - Combustible Solids
深圳康特腾科技有限公司
86-0755-86635001 · [email protected]
台州川旭医药科技有限公司[email protected] · [email protected]
上海寰川实业有限公司021-61478794 · [email protected]
Chongqing jooe co., ltd+86-15223382610 · [email protected]
武汉峰耀同辉化学制品有限公司027-87466205 15377579727 · [email protected]
湖北扬信医药科技有限公司15374522761 · [email protected]
Shaanxi Dideu New Materials Co. Ltd18192503167 · [email protected]
海蔚化学86-21-51086038 · [email protected]
Alchem Pharmtech,Inc.8485655694 · [email protected]
Baoji Guokang Healthchem Co., Ltd.+86-0917-3909592 +86-13892490616 · [email protected]
AFINE CHEMICALS LIMITED+86-571-85134551 +86-18958018566 · [email protected]
湖北清北云研医药科技有限责任公司18162595016; 18162595016 · [email protected]