Amodiaquine Hydrochloride
Grundinformationen
- CAS
6398-98-7- Standard-SMILES
CCN(CC)Cc1cc(Nc2ccnc3cc(Cl)ccc23)ccc1O.Cl.Cl.O.O- InChIKey
YVNAYSHNIILOJS-UHFFFAOYSA-N- Summenformel
- C20H28Cl3N3O3
- Durchschnittliche Molmasse
- 464,8 g/mol
- Monoisotopische Masse
- 463,119625
Überblick
Amodiaquine Hydrochloride is the hydrochloride salt of amodiaquine, an orally active 4-aminoquinoline derivative with antimalarial and anti-inflammatory properties. Similar in structure and activity to chloroquine, amodiaquine is effective against some chloroquine-resistant strains, particularly Plasmodium falciparum, the most deadly malaria parasite. Although the mechanism of plasmodicidal action has not been fully elucidated, like other quinoline derivatives, amodiaquine likely is able to inhibit heme polymerase activity in the body. This results in accumulation of free heme, which is toxic to the parasites.
Namen und Bezeichner
- Bevorzugter Name
- Amodiaquine Hydrochloride
- IUPAC
- 4-[(7-chloroquinolin-4-yl)amino]-2-(diethylaminomethyl)phenol;dihydrate;dihydrochloride
- Englischer Name
- Amodiaquin dihydrochloride dihydrate
- Summenformel
- C20H25Cl2N3O2
- Molmasse
- 410.34
Namen und Synonyme
Amodiaquine hydrochlorideAmodiaquine HClAmodiaquini hydrochloridumNSC-755863K6PW2S574LCAMOQUIN HYDROCHLORIDEPhenol, 4-((7-chloro-4-quinolinyl)amino)-2-((diethylamino)methyl)-, dihydrochloride, dihydrateCHEBI:50652DTXSID20219036Camoquin Hcl4-((7-Chloro-4-quinolyl)amino)-alpha-(diethylamino)-o-cresol dihydrochlorideRefChem:54178
Weitere Namen anzeigen
Amodiaquine HCLrAmodiaquin DihydrateAMODIAQUIN HYDROCHLORIDEDihydrochloride dihydrateAMODIAQUIN DIHYDROCHLORIDEAMODIAQUINE 2HCL DIHYDRATEAmodiaquin diHCl dihydrateAMODIAQUINE DIHYDROCHLORIDE
DTXCID40141527200-706-069-44-3HOE64181MPAmodiaquin dihydrochloride dihydrateAmodiaquin HCl hydrate4-((7-Chloroquinolin-4-yl)amino)-2-((diethylamino)methyl)phenol dihydrochloride dihydrateDTXSID3045568
Datenbank-Bezeichner
Eigenschaften
Berechnete Struktureigenschaften
- Polarare Oberfläche (TPSA)
- 50,4 Ų
- H-Brücken-Donoren
- 6
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 6
- Schwere Atome
- 29
- Formalladung
- 0
- Komplexität
- 406
Experimentelle und physikochemische Eigenschaften
Human Drugs
FDA approved drugs -> Active ingredient
FDA approved drugs -> Active ingredient
Physikochemische Eigenschaften
- storage temp.
- Inert atmosphere,Room Temperature
- Löslichkeit
- Soluble in DMSO or methanol
- Aggregatzustand
- Solid
- Farbe
- White to Yellow to Orange
- Merck
- 14 · 14,572
- Stabilität
- Hygroscopic
- Major Application
- forensics and toxicologypharmaceutical (small molecule)
- InChI
- InChI=1S/C20H22ClN3O.ClH.H2O/c1-3-24(4-2)13-14-11-16(6-8-20(14)25)23-18-9-10-22-19-12-15(21)5-7-17(18)19;;/h5-12,25H,3-4,13H2,1-2H3,(H,22,23);1H;1H2
- InChIKey
- AOFIMJMWPZOPAJ-UHFFFAOYSA-N
- SMILES
- N(C1C=CC(O)=C(CN(CC)CC)C=1)C1=CC=NC2=CC(Cl)=CC=C12.Cl.O
- CAS Datenbank
- 6398 · 6398-98-7(CAS DataBase Reference)
Sicherheit und Regulatorisches
Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.
GHS-Klassifizierung
GHS Classification
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
Other Safety InformationIMAP assessments - Phenol, 4-[(7-chloro-4-quinolinyl)amino]-2-[(diethylamino)methyl]-, dihydrochloride: Environment tier I assessment
Hazard Classes and CategoriesAcute Tox. 4 (100%)
Sicherheitsdaten
- wgk
- 3
- hs_code
- 2933492250
- Speicherklasse
- 11 - Combustible Solids
Chemie und Industrie
Pharmakologische Informationen
MeSH Pharmacological ClassificationAgents used in the treatment of malaria. They are usually classified on the basis of their action against plasmodia at different stages in their life cycle in the human. (From AMA, Drug Evaluations Annual, 1992, p1585)
Anwendungen
Verwendenantimalarial
Anbieter100 Anbieter
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