基本情報
- CAS
3598-37-6- 標準SMILES
CC(=O)c1ccc2c(c1)N(CCCN(C)C)c1ccccc1S2.O=C(O)/C=C\C(=O)O- InChIKey
FQRHOOHLUYHMGG-BTJKTKAUSA-N- 分子式
- C23H26N2O5S
- 平均分子量
- 442.5 g/mol
- 単同位体質量
- 442.15624293
概要
Acepromazine Maleate is the maleate salt of acepromazine, a phenothiazine derivative with depressant effect on the central nervous system. Acepromazine acts as a dopamine receptor antagonist in the CNS, thereby causing sedation, muscular relaxation and a reduction in spontaneous activity. Its fast-acting neuroleptic effect with low toxicity is of particular value in veterinary medicine.
名称と識別子
- 優先名称
- Acepromazine Maleate
- IUPAC
- (Z)-but-2-enedioic acid;1-[10-[3-(dimethylamino)propyl]phenothiazin-2-yl]ethanone
- 現地名
- マレイン酸アセプロマジン
- 英語名
- ACEPROMAZINE MALEATE
- 分子式
- C23H26N2O5S
- 分子量
- 442.53
名称と別名
名称をさらに表示
データベース識別子
- CAS
3598-37-6- PubChem CID
- 6420038
- DTXSID
DTXSID6047783- ChEMBL
CHEMBL1883146- UNII
- 37862HP2OM
- EC Number
- 222-748-9
物性
構造計算による物性
- 極性表面積
- 123 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 8
- 回転可能結合数
- 7
- 重原子数
- 31
- 形式電荷
- 0
- 複雑度
- 533
実験および物理化学的性質
物理化学的性質
- 融点
- 135 · 135-136°C
- 貯蔵温度
- room temp
- 溶解性
- 2 O: · H2O: >10mg/mL
- 酸解離定数(Pka)
- 9.3 · 9.3(at 25℃)
- 外見
- 粉
- 色
- 黄色
- 水溶解度
- 2 O: · H2O: >10mg/mL
- InChIKey
- FQRHOOHLUYHMGG-BTJKTKAUSA-N
- SMILES
- C12=CC(=CC=C1SC1C=CC=CC=1N2CCCN(C)C)C(=O)C.C(/C(=O)O)=C/C(=O)O
化学的性質
化学的特性Yellow Crystalline Solid
安全と法規制
GHS分類
GHS Classification
Warning
H302 (97.7%): Harmful if swallowed [Warning Acute toxicity, oral]
P261, P264, P270, P271, P280, P301+P317, P302+P352, P304+P340, P317, P321, P330, P362+P364, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 44 reports by companies from 5 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
危険有害性情報
安全データ
- wgk
- 2
- rtecs
- 2664-15-5
- ridadr
- UN 3077
- 毒性
- LD50 orally in rats: 400 mg/kg; i.v. in mice: 59 mg/kg (Wirth)
- hs_code
- 2934302300
- risk_code
- 22-50/53-20/21/22-43-36/37/38-23/24/25
- hazard_code
- Xn,N,T
- safety_code
- 60-61-36/37/39-26-22-45
- Hazard Classifications
- Acute Tox. 3 OralSTOT SE 3
- ストレージクラス
- 6.1C - Combustible acute toxic Cat.3toxic compounds or compounds which causing chronic effects
化学と産業
薬理情報
MeSH Pharmacological Classification
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
応用分野
説明Acepromazine is a phenothiazine antipsychotic, analog of chlorpromazine , and a dopamine receptor antagonist. It also binds to muscarinic receptors in rat brain (IC50 = 350 nM) and inhibits contractions of guinea pig ileum induced by acetylcholine (; IC50 = 840 nM). Acepromazine inhibits morphine-induced vomiting in dogs. It also inhibits development of a conditioned avoidance response, unconditioned escape response, and catalepsy in rats (ED50s = 0.98, 3.1, and 17 mg/kg, respectively). Formulations containing acepromazine have been used as tranquilizers and anesthetics premedicant in small and large animal veterinary care.
使用Acepromazine maleate has been used:as a component of anesthesia cocktail to test its effects on behavioral changes in ratsas a component of anesthesia cocktail to study its effects on lung resistance of ratsas an anti-psychotic pharmaceutical agent to study its cytotoxic effects on malignant glioma in glioblastoma (GBM) cells
上流・下流製品情報
上流原料
サプライヤー100 社
関連反応
化合物ノート
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