5-Chloro-N-(4-(5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2H)-pyridinyl)phenyl)pentanamide
Grundinformationen
- CAS
1643330-62-4- Standard-SMILES
O=C(CCCCCl)Nc1ccc(N2CCC=C(N3CCOCC3)C2=O)cc1- InChIKey
YWWKAVVYOWDKHS-UHFFFAOYSA-N- Summenformel
- C20H26ClN3O3
- Durchschnittliche Molmasse
- 391,9 g/mol
- Monoisotopische Masse
- 391,1662694
Namen und Bezeichner
- Bevorzugter Name
- 5-Chloro-N-(4-(5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2H)-pyridinyl)phenyl)pentanamide
- IUPAC
- 5-chloro-N-[4-(5-morpholin-4-yl-6-oxo-2,3-dihydropyridin-1-yl)phenyl]pentanamide
- Englischer Name
- 5-chloro-N-(4-(5-morpholino-6-oxo-3,6-dihydropyridin-1(2H)-yl)phenyl)pentanamide
- Summenformel
- C20H26ClN3O3
- Molmasse
- 391.89
Namen und Synonyme
1643330-62-4V9YK56W8PQ5-Chloro-N-(4-(5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2H)-pyridinyl)phenyl)pentanamide5-Chloro-N-[4-[5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2H)-pyridinyl]phenyl]pentanamideRefChem:10728125-Chloro-n-(4-(5-morpholino-6-oxo-3,6-dihydropyridin-1(2h)-yl)phenyl)pentanamide5-chloro-N-(4-(3-morpholino-2-oxo-5,6-dihydropyridin-1(2H)-yl)phenyl)pentanamide5-Chloropentanamide ApixabanMFCD28347530Pentanamide, 5-chloro-N-(4-(5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2H)-pyridinyl)phenyl)-5-Chloro-N-[4-(3-morpholino-2-oxo-5,6-dihydropyridin-1(2H)-yl)phenyl]pentanamideApixaban Impurity 3; 5-Chloro-N-(4-(3-morpholino-2-oxo-5,6-dihydropyridin-1(2H)-yl)phenyl)pentanamide
Weitere Namen anzeigen
Apixaban-11Apixaban Impurity S2Impurity of apixaban373Apixaban Impurity AP-SM3-M2Pentanamide, 5-chloro-N-[4-[5,6-dihydro-3-(4-morpholinyl)-2-oxo-1(2H)-pyridinyl]phenyl]-Apixaban impurity 8/5-chloro-N-(4-(5-morpholino-6-oxo-3,6-dihydropyridin-1(2H)-yl)phenyl)pentanamide
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,2
- Polarare Oberfläche (TPSA)
- 61,9 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 27
- Formalladung
- 0
- Komplexität
- 541
Physikochemische Eigenschaften
- Siedepunkt
- 626.5 · 626.5±55.0 °C(Predicted)
- Dichte
- 1.282 · 1.282±0.06 g/cm3(Predicted)
- storage temp.
- 2 · 2-8°C, protect from light
- pka
- 14.38 · 14.38±0.70(Predicted)
Chemie und Industrie
Anwendungen
Verwenden5-Chloropentanamide Apixaban is an impurity of Apixaban (503612-47-3 #CAS), which is a potent, direct, selective, and orally active inhibitor of coagulation factor Xa. It is a potential new oral coagulant that may be useful prevention of venous thromboembolism in total hip, knee replacement orthopedic surgery and stroke in treatment of patient with venous thromboembolic disorder or with atrial fibrillation.
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