Win 35428

HCID 105056CAS 50370-56-4

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Grundinformationen

Standard-SMILES: COC(=O)[C@H]1[C@@H](c2ccc(F)cc2)C[C@@H]2CC[C@H]1N2C
InChIKey: QUSLQENMLDRCTO-YJNKXOJESA-N
Summenformel: C16H20FNO2
Durchschnittliche Molmasse: 277,33 g/mol

Überblick

WIN-35428 is an organic molecular entity. It has a role as a dopamine uptake inhibitor.

Namen und Bezeichner

Bevorzugter Name: Win 35428
IUPAC: methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate

Namen und Synonyme

50370-56-4beta-CftWin 354282-CmftWIN354282-CFTWIN 35,428Win-35428methyl (1R,2S,3S,5S)-3-(4-fluorophenyl)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate2-Carbomethoxy-3-(4-fluorophenyl)tropane8ZT6KJ947T2beta-carbomethoxy-3beta-(4-fluorophenyl)tropane

Weitere Namen anzeigen

(1R-(exo,exo))-3-(4-Fluorophenyl)-8-methyl-8-azabicyclo(3.2.1)octane-2-carboxylic acid, methyl ester8-Azabicyclo(3.2.1)octane-2-carboxylic acid, 3-(4-fluorophenyl)-8-methyl-, methyl ester, (1R,2S,3S,5S)-(-)-WIN 35,428DTXSID30198424CFT cpdMETHYL (1R,2S,3S,5S)-3-(4-FLUOROPHENYL)-8-METHYL-8-AZABICYCLO(3.2.1)OCTANE-2-CARBOXYLATEWin-35,4288-azabicyclo[3.2.1]octane-2-carboxylic acid, 3-(4-fluorophenyl)-8-methyl-, methyl ester, (1R,2S,3S,5S)-

Datenbank-Bezeichner

CAS: 50370-56-4
PubChem CID: 105056
ChEMBL: CHEMBL1944829
ChEBI: CHEBI:232539
UNII: 8ZT6KJ947T
EC Number: 637-133-4
Nikkaji: J23.648I、J409.121C

Eigenschaften

Berechnete Struktureigenschaften

XLogP: 2,7
Polarare Oberfläche (TPSA): 29,5 Å²
H-Brücken-Donoren: 0
H-Brücken-Akzeptoren: 4
Frei drehbare Bindungen: 3
Schwere Atome: 20
Formalladung: 0
Komplexität: 367

Sicherheit und Regulatorisches

GHS-Klassifizierung

GHS Classification · 4 Einträge

Danger

H300 (100%): Fatal if swallowed [Danger Acute toxicity, oral]

P203, P260, P261, P262, P264, P270, P271, P272, P280, P284, P301+P316, P302+P352, P304+P340, P316, P318, P320, P321, P330, P333+P317, P361+P364, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Gefahrenhinweise

Hazard Classes and CategoriesAcute Tox. 2 (100%)

Chemie und Industrie

Pharmakologische Informationen

MeSH Pharmacological ClassificationDrugs that block the transport of DOPAMINE into axon terminals or into storage vesicles within terminals. Most of the ADRENERGIC UPTAKE INHIBITORS also inhibit dopamine uptake.