基本情報
- CAS
62613-82-5- 標準SMILES
NC(=O)CN1CC(O)CC1=O- InChIKey
IHLAQQPQKRMGSS-UHFFFAOYSA-N- 分子式
- C6H10N2O3
- 平均分子量
- 158.16 g/mol
- 単同位体質量
- 158.06914218
概要
Oxiracetam is an organonitrogen compound and an organooxygen compound. It is functionally related to an alpha-amino acid.
名称と識別子
- 優先名称
- Oxiracetam
- IUPAC
- 2-(4-hydroxy-2-oxopyrrolidin-1-yl)acetamide
- 現地名
- オキシラセタム
- 英語名
- Oxiracetam
- 分子式
- C6H10N2O3
- 分子量
- 158.16
名称と別名
名称をさらに表示
データベース識別子
- CAS
62613-82-5- PubChem CID
- 4626
- DTXSID
DTXSID9045180- ChEMBL
CHEMBL36633- ChEBI
CHEBI:134788- UNII
- P7U817352G
- EC Number
- 636-370-0
- Nikkaji
- J19.582K
物性
構造計算による物性
- XLogP
- -2.2
- 極性表面積
- 83.6 Ų
- 水素結合供与体数
- 2
- 水素結合受容体数
- 3
- 回転可能結合数
- 2
- 重原子数
- 11
- 形式電荷
- 0
- 複雑度
- 192
実験および物理化学的性質
物理化学的性質
- 融点
- 165 · 165-168 °C
- 沸点
- 494.6 · 494.6±40.0 °C(Predicted)
- 比重(密度)
- 1.416 · 1.416
- 貯蔵温度
- Sealed in dry,Room Temperature
- 溶解性
- DMSO(微加熱)、メタノール(微加熱)
- 外見
- 個体
- 酸解離定数(Pka)
- 13.76 · 13.76±0.20(Predicted)
- 色
- ホワイトからオフホワイト
- Merck
- 14 · 14,6942
- InChI
- InChI=1S/C6H10N2O3/c7-5(10)3-8-2-4(9)1-6(8)11/h4,9H,1-3H2,(H2,7,10)
- InChIKey
- IHLAQQPQKRMGSS-UHFFFAOYSA-N
- SMILES
- N1(CC(N)=O)CC(O)CC1=O
- CAS データベース
- 62613 · 62613-82-5(CAS DataBase Reference)
化学的性質
化学的特性Whie Solid
安全と法規制
GHS分類
GHS Classification
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, and P362+P364 (click each P-code to see the statement)
Aggregated GHS information provided per 39 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
安全データ
- wgk
- 3
- rtecs
- UX9656638
- hs_code
- 2933.79.8500
- risk_code
- 36/38
- hazard_code
- Xi
- safety_code
- 26-36
- ストレージクラス
- 11 - Combustible Solids
化学と産業
薬理情報
ATC Code
N - Nervous system
QN - Nervous system
MeSH Pharmacological Classification
A loosely defined grouping of drugs that have effects on psychological function. Here the psychotropic agents include the antidepressive agents, hallucinogens, and tranquilizing agents (including the antipsychotics and anti-anxiety agents).
Drugs used to specifically facilitate learning or memory, particularly to prevent the cognitive deficits associated with dementias. These drugs act by a variety of mechanisms.
応用分野
説明Oxiracetam is a structural analogue of piracetam. This compound has enhancing effects on vigilance and memory. In comparison with piracetam, oxiracetam exhibits greater improvement in memory (Itil et al., 1986) and has been used extensively for the treatment of dementia, including AD, VaD, MID (Baumel et al., 1989; Dysken et al., 1989), and mixed forms. Green et al. (1992) failed to demonstrate a difference from placebo in AD patients. In contrast, Maina et al. (1989) studied 289 patients with MID in a double-blind placebo-controlled trial and after 12 weeks of treatment found that oxiracetam reduced behavioural symptoms.
使用Oxiracetam is a 4-hydroxy analog of piracetam with psychostimulant activity, reportedly useful in relieving the symptoms of cerebral insufficiency in the elderly.
調製方法
純化方法This nootropic (Alzheimer) drug is purified by recrystallisation from MeOH or aqueous Me2CO and dried in vacuo. [NMR, IR: Pifferi & Pinza Farmaco Ed Sci 32 602 1977, Banfi et al. Farmaco Ed Sci 39 16 1984, Gouilaev & Senning Brain Research Rev 19 180 1994.]
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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