基本情報
- CAS
31352-82-6- 標準SMILES
Cc1nn(C)c2c1C(c1ccccc1F)=NCC(=O)N2C- InChIKey
GDSCFOSHSOWNDL-UHFFFAOYSA-N- 分子式
- C15H15FN4O
- 平均分子量
- 286.3 g/mol
- 単同位体質量
- 286.12298928
概要
Zolazepam is a pyrazolodiazepinone derivative used as an anaesthetic in veterinary medicine. Zolazepam is typically used in combination with the NMDA antagonist tiletamine or the α2 adrenoceptor agonist xylazine. It is around four times the potency of diazepam but it is both water-soluble and un-ionized at physiological pH meaning that its onset is very fast.
名称と識別子
- 優先名称
- Zolazepam
- IUPAC
- 4-(2-fluorophenyl)-1,3,8-trimethyl-6H-pyrazolo[5,4-e][1,4]diazepin-7-one
- 現地名
- 4-(2-フルオロフェニル)-6,8-ジヒドロ-1,3,8-トリメチルピラゾロ[3,4-e][1,4]ジアゼピン-7(1H)-オン
- 英語名
- Zolazepam
- 分子式
- C15H15FN4O
- 分子量
- 286.309
名称と別名
ZOLAZEPAM31352-82-6ZolazepamumCI 716G1R474U58UPyrazolo(3,4-e)(1,4)diazepin-7(1H)-one, 4-(2-fluorophenyl)-6,8-dihydro-1,3,8-trimethyl-DTXSID30185278ZolasepamRefChem:196213DTXCID401077694-(2-fluorophenyl)-1,3,8-trimethyl-1H,6H,7H,8H-pyrazolo(3,4-e)(1,4)diazepin-7-oneFlupyrazapon
名称をさらに表示
ゾラゼパム4-(2-フルオロフェニル)-6,8-ジヒドロ-1,3,8-トリメチルピラゾロ[3,4-e][1,4]ジアゼピン-7(1H)-オン4-(2-フルオロフェニル)-1,3,8-トリメチル-1H,6H,7H,8H-ピラゾロ[3,4-e][1,4]ジアゼピン-7-オンCL-7164-(o-Fluorophenyl)-6,8-dihydro-1,3,8-triMethylpyrazolo[3,4-e][1,4]diazepin-7(1H)-one4-(2-Fluorophenyl)-6,8-dihydro-1,3,8-trimethylpyrazolo[3,4-e][1,4]diazepin-7(1H)-one4-(2-Fluorophenyl)-6,8-dihydro-1,3,8-triMethylpyrazolo[3,4-e][1,4]diazepin-7(1H)-one-d3Pyrazolo[3,4-e][1,4]diazepin-7(1H)-one, 4-(2-fluorophenyl)-6,8-dihydro-1,3,8-trimethyl-
Zolazepam [INN:BAN]Zolazepamum [INN-Latin]UNII-G1R474U58UDEA No. 72954-(2-fluorophenyl)-1,3,8-trimethyl-6H-pyrazolo[3,4-e][1,4]diazepin-7-one4-(2-Fluorophenyl)-1,3,8-trimethyl-6,8-dihydropyrazolo[3,4-e][1,4]diazepin-7(1H)-one4-(2-Fluorophenyl)-6,8-dihydro-1,3,8-trimethylpyrazolo-(3,4-e)(1,4)diazepin-7(1H)-oneZOLAZEPAM [INN]
物性
構造計算による物性
- XLogP
- 1.7
- 極性表面積
- 50.5 Ų
- 水素結合供与体数
- 0
- 水素結合受容体数
- 4
- 回転可能結合数
- 1
- 重原子数
- 21
- 形式電荷
- 0
- 複雑度
- 455
実験および物理化学的性質
Drugs
DEA NFLIS-Drug Category -> Benzodiazepines
Pharmaceuticals -> Synthetic Cannabinoids or Psychoactive Compounds
Animal Drugs
Pharmaceuticals -> UK Veterinary Medicines Directorate List
Pharmaceuticals -> Animal Drugs -> Approved in Taiwan
Collision Cross Section162.3 Ų [M+H]+ [CCS Type: TW; Method: Major Mix IMS/Tof Calibration Kit (Waters)]
物理化学的性質
- 融点
- 183 · 183-185 °C(Solv: methanol (67-56-1); ethyl ether (60-29-7))
- 沸点
- 506.6 · 506.6±50.0 °C(Predicted)
- 比重(密度)
- 1.31 · 1.31±0.1 g/cm3(Predicted)
- 溶解性
- 1 mg/ml; · DMF: 1 mg/ml; DMSO: 1 mg/ml; DMSO:PBS (pH 7.2) (1:2): 0.33 mg/ml
- 外見
- A crystalline solid
- 酸解離定数(Pka)
- 1.85 · 1.85±0.20(Predicted)
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
Warning
H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]
P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, 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 CategoriesSkin Irrit. 2 (100%)
安全データ
- 危険有害性情報
- コード 危険有害性情報 危険有害性クラス 区分 注意喚起語 シンボル P コード H315
化学と産業
薬理情報
MeSH Pharmacological Classification
Agents that alleviate ANXIETY, tension, and ANXIETY DISORDERS, promote sedation, and have a calming effect without affecting clarity of consciousness or neurologic conditions. ADRENERGIC BETA-ANTAGONISTS are commonly used in the symptomatic treatment of anxiety but are not included here.
Substances that do not act as agonists or antagonists but do affect the GAMMA-AMINOBUTYRIC ACID receptor-ionophore complex. GABA-A receptors (RECEPTORS, GABA-A) appear to have at least three allosteric sites at which modulators act: a site at which BENZODIAZEPINES act by increasing the opening frequency of GAMMA-AMINOBUTYRIC ACID-activated chloride channels; a site at which BARBITURATES act to prolong the duration of channel opening; and a site at which some steroids may act. GENERAL ANESTHETICS probably act at least partly by potentiating GABAergic responses, but they are not included here.
用途と製造
Use ClassificationPharmaceuticals -> Animal Drugs -> Approved in Taiwan
応用分野
使用A sedative and anesthetic
サプライヤー13 社
Career Henan Chemica Co+86-0371-86658258 +86-13203830695 · [email protected]
VladaChem GmbH+49-7246-3082843 +86-18411632868 · [email protected]
Syntechem Co.,Ltd[email protected]
凯试(上海)科技有限公司021-50135380 · [email protected]
上海陶术生物科技股份有限公司
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