6-Methoxy-N-[[1-(2-propen-1-yl)-2-pyrrolidinyl]methyl]-1H-benzotriazole-5-carboxamide

HCID 43008CAS 59338-93-1

Grundinformationen

Standard-SMILES
C=CCN1CCCC1CNC(=O)c1cc2n[nH]nc2cc1OC
InChIKey
KSEYRUGYKHXGFW-UHFFFAOYSA-N
Summenformel
C16H21N5O2
Durchschnittliche Molmasse
315,37 g/mol
Monoisotopische Masse
315,16952491

Überblick

Alizapride is a dopamine antagonist that is capable of demonstrating both prokinetic and antiemetic effects. This kind of pharmacological activity makes it effective for use in the treatment of various kinds of nausea and vomiting, including that which may occur postoperatively.

Namen und Bezeichner

Bevorzugter Name
6-Methoxy-N-[[1-(2-propen-1-yl)-2-pyrrolidinyl]methyl]-1H-benzotriazole-5-carboxamide
IUPAC
6-methoxy-N-[(1-prop-2-enylpyrrolidin-2-yl)methyl]-2H-benzotriazole-5-carboxamide

Namen und Synonyme

6-Methoxy-N-[[1-(2-propen-1-yl)-2-pyrrolidinyl]methyl]-1H-benzotriazole-5-carboxamideNausilexUNII-P55703ZRZYSCHEMBL48936orb1689218SCHEMBL1649436SCHEMBL30089955GTPL11141KSEYRUGYKHXGFW-UHFFFAOYSA-NHY-A0125EINECS 261-710-6BRN 6432438
Weitere Namen anzeigen
AC-22579DB-053369CS-0017442NS00009083T60813Q6318291H-Benzotriazole-5-carboxamide, 6-methoxy-N-((1-(2-propenyl)-2-pyrrolidinyl)methyl)-6-Methoxy-N-((1-(2-propenyl)-2-pyrrolidinyl)methyl)-1H-benzotriazole-5-carboxamide

Datenbank-Bezeichner

CAS
59338-93-1
PubChem CID
43008
DTXSID
DTXSID10866755
Nikkaji
J10.911H

Eigenschaften

Berechnete Struktureigenschaften

XLogP
1,5
Polarare Oberfläche (TPSA)
83,1 Ų
H-Brücken-Donoren
2
H-Brücken-Akzeptoren
5
Frei drehbare Bindungen
6
Schwere Atome
23

Experimentelle und physikochemische Eigenschaften

DrugsPharmaceuticals
LogP · 2 Einträge

1.79

2.22

Solubility4.95e-01 g/L
Melting Point139 °C
Physical DescriptionSolid

Chemie und Industrie

Pharmakologische Informationen

PharmacodynamicsAlizapride is a dopamine antagonist.
Mechanism of Action · 1 Eintrag

The anti-emetic action of Alizapride is due to its antagonist activity at D2 receptors in the chemoreceptor trigger zone (CTZ) in the central nervous system (CNS)—this action prevents nausea and vomiting triggered by most stimuli. Structurally similar to metoclopramide and, therefore, shares similar other atributres related to emesis and prokinetics.

Biological Half-Life3 hours
Absorption, Distribution and Excretionrenal
Cellular LocationsMembrane

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