ファスジル塩酸塩

Fasudil Hydrochloride

HCID 163751
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基本情報

CAS
105628-07-7
標準SMILES
Cl.O=S(=O)(c1cccc2cnccc12)N1CCCNCC1
InChIKey
LFVPBERIVUNMGV-UHFFFAOYSA-N
分子式
C14H18ClN3O2S
平均分子量
327.8 g/mol
単同位体質量
327.0808255

概要

Fasudil hydrochloride is a hydrochloride obtained by reaction of fasudil with one equivalent of hydrochloric acid. It has a role as a vasodilator agent, an antihypertensive agent, a calcium channel blocker, an EC 2.7.11.1 (non-specific serine/threonine protein kinase) inhibitor, a neuroprotective agent and a nootropic agent. It contains a fasudil(1+).

名称と識別子

優先名称
Fasudil Hydrochloride
IUPAC
5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;hydrochloride
現地名
ファスジル塩酸塩
英語名
Fasudil hydrochloride
分子式
C14H18ClN3O2S
分子量
327.83

名称と別名

Fasudil hydrochloride105628-07-7Fasudil HClAT 877 hydrochlorideHA 1077 hydrochlorideDTXSID1045615SQ04N8S7BRHexahydro-1-(5-isoquinolinylsulfonyl)-1H-1,4-diazepine monohydrochlorideDTXCID9025615CHEBI:315931H-1,4-Diazepine, hexahydro-1-(5-isoquinolinylsulfonyl)-, monohydrochlorideRefChem:140012
名称をさらに表示
ファスジル塩酸塩1-(5-イソキノリンスルホニル)ホモピペラジン塩酸塩5-(1-ホモピペラジニル)スルホニルイソキノリン塩酸塩塩酸ファスジル (JAN)エリル5-(1,4-ジアゼパン-1-イルスルホニル)イソキノリン=塩酸塩5-(ヘキサヒドロ-1H-1,4-ジアゼピン-1-イルスルホニル)イソキノリン・塩酸塩ファスジル・塩酸塩塩酸ファスジルCS-520HA-1077FASUDELCS-1572Fasudil-HAHA-1077 HClCAS:105628-07-7FASUDIL, MONOHCLFasudil (HA-1077)
805-833-0Eril5-((1,4-Diazepan-1-yl)sulfonyl)isoquinoline hydrochlorideMFCD00943198Fasudil (Hydrochloride)Fasudil, Monohydrochloride Salt5-(1,4-diazepan-1-ylsulfonyl)isoquinoline hydrochlorideREGID_for_CID_4917

データベース識別子

CAS
105628-07-7
PubChem CID
163751
DTXSID
DTXSID1045615
ChEMBL
CHEMBL541388
ChEBI
CHEBI:31593
UNII
SQ04N8S7BR
EC Number
805-833-0

物性

構造計算による物性

極性表面積
70.7 Ų
水素結合供与体数
2
水素結合受容体数
5
回転可能結合数
2
重原子数
21

物理化学的性質

融点
220.5 °; · 220.5°; mp 219.3° (Shirotani)
貯蔵温度
-20 °C · Inert atmosphere,Store in freezer, under -20°C
溶解性
2 O: · H2O: >200 mg/mL
外見
個体
色
白い
水溶解度
水およびジメチルスルホキシドに可溶。エタノールに不溶。

安全と法規制

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)

Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory.

危険有害性情報

Hazard Classes and CategoriesAcute Tox. 4 (100%)

安全データ

wgk
3
rtecs
HM4031166
毒性
LD50 in mice, rats (mg/kg): 67.5, 59.9 i.v.; 124.5, 123.2 s.c.; 273.9, 335.0 orally (Koga)
hs_code
29339900
risk_code
22
safety_code
36-60

化学と産業

薬理情報

MeSH Pharmacological Classification · 3 件

A class of drugs that act by selective inhibition of calcium influx through cellular membranes.

Drugs used to cause dilation of the blood vessels.

Agents that inhibit PROTEIN KINASES.

応用分野 · 3 件

用途サイクリックヌクレオチド依 存的タンパク質キナーゼ阻害剤及び Rho キ ナーゼ阻害作用を示します。

用途サイクリックヌクレオチド依 存的タンパク質キナーゼ阻害剤及びRho キ ナーゼ阻害作用を示します。

説明Fasudil hydrochloride, a novel calcium antagonistic vasodilator, was marketed for the treatment of cerebral vasospasm following subarachnoid hemorrhage (SAH). Fasudil is also a potent inhibitor of myosin light chain kinase and protein kinase C. In contrast to other calcium channel blockers, which regulate the influx of calcium ions through the cell membrane but not involved in the intracellular regulatory mechanism of the calcium, fasudil was suggested to have an intracellular mode of action in relaxing vascular smooth muscle. In patients with neurological deficits due to vasospasm, fasudil decreased the occurrence of angiographic severe and symptomatic vasospasm and cerebral infarction without decreasing systemic blood pressure. Fasudil is reportedly in clinical trials for acute ischemic stroke, sequelae of cerebral vascular diseases and angina pectoris.

上流・下流製品情報

サプライヤー100 社

梯希爱(上海)化成工业发展有限公司021-67121386 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
T&W GROUP021-61551611 13296011611 · [email protected]
河北立业化学制品有限公司0310-6697998 13930001710 · [email protected]
上海迈瑞尔生化科技有限公司4006356688 18621169109 · [email protected]

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