Gsk163090
Grundinformationen
- CAS
844903-58-8- Standard-SMILES
Cc1ccc2c(N3CCN(CCc4cccc(N5CCNC5=O)c4)CC3)cccc2n1- InChIKey
ANGUXJDGJCHGOG-UHFFFAOYSA-N- Summenformel
- C25H29N5O
- Durchschnittliche Molmasse
- 415,5 g/mol
- Monoisotopische Masse
- 415,23721055
Namen und Bezeichner
- Bevorzugter Name
- Gsk163090
- IUPAC
- 1-[3-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]phenyl]imidazolidin-2-one
- Englischer Name
- GSK163090
- Summenformel
- C25H29N5O
- Molmasse
- 415.53
Namen und Synonyme
GSK163090RefChem:782733844903-58-8GSK-1630901-(3-(2-(4-(2-Methylquinolin-5-yl)piperazin-1-yl)ethyl)phenyl)imidazolidin-2-oneMFCD18782711GSK 1630901-(3-(2-(4-(2-Methyl-5-quinolinyl)-1-piperazinyl)ethyl)phenyl)-2-imidazolidinoneCHEMBL16315407XI927X82B1-[3-[2-[4-(2-methylquinolin-5-yl)piperazin-1-yl]ethyl]phenyl]imidazolidin-2-one1-(3-{2-[4-(2-Methyl-5-quinolinyl)-1-piperazinyl]ethyl}phenyl)-2-imidazolidinone
Weitere Namen anzeigen
CS-2298GSK163090 (GSK-163090GSK163090, 10 mM in DMSOGSK 163090.5-HT1A/B/D receptor antagonist GS1630902-Imidazolidinone,1-[3-[2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl]phenyl]-Dopamine Receptor,5-HT1A,GSK163090,Inhibitor,5-hydroxytryptamine Receptor,antidepressant,anxiolytic,SerT,inhibit,5-HT1B,5-HT1D,5-HT Receptor,GSK-163090,GSK 163090,Serotonin Receptor,P-glycoprotein
1-(3-{2-[4-(2-METHYLQUINOLIN-5-YL)PIPERAZIN-1-YL]ETHYL}PHENYL)IMIDAZOLIDIN-2-ONEUNII-7XI927X82B1-[3-[2-[4-(2-methyl-5-quinolinyl)-1-piperazinyl]ethyl]phenyl]-2-imidazolidinoneANGUXJDGJCHGOG-UHFFFAOYSA-N844903-58-8 (GSK-163090 Free base)orb1217603orb1296061SCHEMBL2881345
Datenbank-Bezeichner
- CAS
844903-58-8- PubChem CID
- 11292933
- DTXSID
DTXSID30233480- ChEMBL
CHEMBL1631540- UNII
- 7XI927X82B
- EC Number
- 629-856-9
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,4
- Polarare Oberfläche (TPSA)
- 51,7 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 31
- Formalladung
- 0
- Komplexität
- 607
Physikochemische Eigenschaften
- Dichte
- 1.216 · 1.216±0.06 g/cm3(Predicted)
- storage temp.
- -20 °C · Store at -20°C
- Löslichkeit
- 16.5 mg/mL · DMSO : 16.5 mg/mL (39.71 mM)
- Aggregatzustand
- Solid
- pka
- 14.2 · 14.20±0.20(Predicted)
- Farbe
- White to yellow
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Danger
H301 (100%): Toxic if swallowed [Danger Acute toxicity, oral]
P264, P270, P301+P316, P321, P330, P405, and P501 (click each P-code to see the statement)
The GHS information provided by 1 company from 1 notification to the ECHA C&L Inventory.
Gefahrenhinweise
Hazard Classes and CategoriesAcute Tox. 3 (100%)
Sicherheitsdaten
- Alarmwort
- Achtung
- Gefahrenhinweise
- Code Gefahrenhinweise Gefahrenklasse Abteilung Alarmwort Symbol P-Code H301
Chemie und Industrie
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