ブロマジン塩酸塩
Bromodiphenhydramine Hydrochloride
基本情報
- CAS
1808-12-4- 標準SMILES
CN(C)CCOC(c1ccccc1)c1ccc(Br)cc1.Cl- InChIKey
ZQDJSWUEGOYDGT-UHFFFAOYSA-N- 分子式
- C17H21BrClNO
- 平均分子量
- 370.7 g/mol
- 単同位体質量
- 369.0495
概要
Bromodiphenhydramine Hydrochloride is the hydrochloride salt form of bromodiphenhydramine, a synthetic ethanolamine with histamine H1 antagonistic and sedative properties. Bromodiphenhydramine hydrochloride blocks the H1 histamine receptor and prevents the symptoms that are caused by histamine activity on capillaries, bronchial smooth muscle, and gastrointestinal smooth muscle, including vasodilation, increased capillary permeability, bronchoconstriction, and spasmodic contraction of gastrointestinal smooth muscle. This drug also prevents histamine-induced pain and itching of mucous membranes.
名称と識別子
- 優先名称
- Bromodiphenhydramine Hydrochloride
- IUPAC
- 2-[(4-bromophenyl)-phenylmethoxy]-N,N-dimethylethanamine;hydrochloride
- 現地名
- ブロマジン塩酸塩
- 英語名
- Bromazine Hydrochloride
- 分子式
- C17H21BrClNO
- 分子量
- 370.71174
名称と別名
Bromazine hydrochloride1808-12-4Bromodiphenhydramine hydrochlorideBromodiphenhydramine HClAmbodrylAmbodryl hydrochlorideNSC-36113Bromodiphenhydramine hydrochloride [USP]beta-(p-Bromobenzhydryloxy)ethyldimethylamine hydrochloride2-(4-Bromobenzohydryloxy)-ethyl-dimethylamine hydrochloride202J683U97DTXSID70904541
名称をさらに表示
ブロマジン塩酸塩ブロモジフェンヒドラミン塩酸塩2-[α-(4-ブロモフェニル)ベンジルオキシ]-N,N-ジメチルエタンアミン・塩酸塩2-[(4-ブロモフェニル)フェニルメトキシ]-N,N-ジメチルエタンアミン・塩酸塩deserolbromazinCetirizine-dBromazine HClbromo-benzdrylEINECS 204-238-8ambodrylhydrochlorideDIPHENHYDRAMINE EP IMP C
2-((p-Bromo-alpha-phenylbenzyl)oxy)-N,N-dimethylethylamine hydrochlorideEthanamine, 2-((4-bromophenyl)phenylmethoxy)-N,N-dimethyl-, hydrochorideNSC36113Bromodiphenhydramine hydrochloride (USP)CHEBI:59178RefChem:54558DTXCID301333681217-310-9
物性
構造計算による物性
- 極性表面積
- 12.5 Ų
- 水素結合供与体数
- 1
- 水素結合受容体数
- 2
- 回転可能結合数
- 6
- 重原子数
- 21
- 形式電荷
- 0
- 複雑度
- 258
実験および物理化学的性質
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
物理化学的性質
- 融点
- 144 · 144-145°
- 貯蔵温度
- Refrigerator
- 溶解性
- アセトン（微量）、メタノール（微量）、水（微量）
- 外見
- 個体
- 色
- ペールイエロー
- BRN
- 3754363 · 3754363
- 主な用途
- 医薬品（低分子化合物）
- InChI
- InChI=1S/C17H20BrNO.ClH/c1-19(2)12-13-20-17(14-6-4-3-5-7-14)15-8-10-16(18)11-9-15;/h3-11,17H,12-13H2,1-2H3;1H
- InChIKey
- ZQDJSWUEGOYDGT-UHFFFAOYSA-N
- SMILES
- C(OCCN(C)C)(C1=CC=CC=C1)C1=CC=C(Br)C=C1.Cl
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
Danger
H301 (50%): Toxic if swallowed [Danger Acute toxicity, oral]
P203, P264, P270, P280, P301+P316, P301+P317, P318, P321, P330, P405, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
Hazard Classes and CategoriesAcute Tox. 4 (50%)
安全データ
- wgk
- WGK 1
- hs_code
- 2922190900
- Hazard Classifications
- Acute Tox. 4 Oral
- ストレージクラス
- 11 - Combustible Solids
化学と産業
応用分野
説明Bromodiphenhydramine is a histamine H1 receptor antagonist. It induces histamine release in isolated guinea pig lung when used at a concentration of 1 mM but completely prevents ovalbumin-induced histamine release in lungs isolated from ovalbumin-sensitized guinea pigs when used at concentrations of 100 and 200 μg/ml. Bromodiphenhydramine (17 mg/kg) inhibits formalin-induced paw edema in rats. It increases survival in a mouse model of systemic S. typhimurium infection when administered at doses of 1.5 and 3 mg/kg.
使用Antihistaminic.
一般的な説明Bromodiphenhydraminehydrochloride, 2-[(4-bromophenyl)-phenylmethoxy]-N, N-dimethylethanamine hydrochloride(Ambodryl Hydrochloride), is a white to pale buff crystallinepowder that is freely soluble in water and in alcohol.Relative to diphenhydramine, bromodiphenhydramine ismore lipid soluble and was twice as effective in protectingagainst the lethal effects of histamine aerosols.
補足説明
定義ChEBI: The hydrochloride salt of bromazine. An antihistamine with antimicrobial properties, it is used in the control of cutaneous allergies.
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