Fasudil Hydrochloride

HCID 163751CAS 105628-07-7

Grundinformationen

Standard-SMILES
Cl.O=S(=O)(c1cccc2cnccc12)N1CCCNCC1
InChIKey
LFVPBERIVUNMGV-UHFFFAOYSA-N
Summenformel
C14H18ClN3O2S
Durchschnittliche Molmasse
327,8 g/mol
Monoisotopische Masse
327,0808255

Überblick

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+).

Namen und Bezeichner

Bevorzugter Name
Fasudil Hydrochloride
IUPAC
5-(1,4-diazepan-1-ylsulfonyl)isoquinoline;hydrochloride
Englischer Name
Fasudil hydrochloride
Summenformel
C14H18ClN3O2S
Molmasse
327.83

Namen und Synonyme

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
Weitere Namen anzeigen
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

Datenbank-Bezeichner

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

Eigenschaften

Berechnete Struktureigenschaften

Polarare Oberfläche (TPSA)
70,7 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
5
Frei drehbare Bindungen
2
Schwere Atome
21

Physikochemische Eigenschaften

Schmelzpunkt
220.5 °; · 220.5°; mp 219.3° (Shirotani)
storage temp.
-20 °C · Inert atmosphere,Store in freezer, under -20°C
Löslichkeit
2 O: · H2O: >200 mg/mL
Aggregatzustand
solid
Farbe
white
Wasserlöslichkeit
Soluble in water and dimethyl sulfoxide. Insoluble in ethanol.

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

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.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 4 (100%)

Sicherheitsdaten

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

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological Classification · 3 Einträge

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.

Anwendungen · 1 Eintrag

BeschreibungFasudil 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.

Anbieter50 Anbieter

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