Balaglitazone
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Grundinformationen
- CAS
199113-98-9- Standard-SMILES
Cn1c(COc2ccc(CC3SC(=O)NC3=O)cc2)nc2ccccc2c1=O- InChIKey
IETKPTYAGKZLKY-UHFFFAOYSA-N- Summenformel
- C20H17N3O4S
- Durchschnittliche Molmasse
- 395,4 g/mol
- Monoisotopische Masse
- 395,09397721
Namen und Bezeichner
- Bevorzugter Name
- Balaglitazone
- IUPAC
- 5-[[4-[(3-methyl-4-oxoquinazolin-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione
- Englischer Name
- Balaglitazone
- Summenformel
- C20H17N3O4S
- Molmasse
- 395.43
Namen und Synonyme
Balaglitazone199113-98-9DRF-2593NN-2344balaglitazona5-({4-[(3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)methoxy]phenyl}methyl)-1,3-thiazolidine-2,4-dione4M1609828ODTXSID30870213balaglitazonum5-((4-((3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)methoxy)phenyl)methyl)-1,3-thiazolidine-2,4-dioneRefChem:116359DTXCID80817996
Weitere Namen anzeigen
Nn2344Drf 2593DRF2593NN2344DRF 2593NN 23445-[[4-[(3-methyl-4-oxoquinazolin-2-yl)methoxy]phenyl]methyl]-1,3-thiazolidine-2,4-dione(+/-)-5-(p-((3,4-Dihydro-3-methyl-4-oxo-2-quinazolinyl)methoxy)benzyl)-2,4-thiazolidinedione5-[[4-[(3,4-dihydro-3-methyl-4-oxo-2-quinazolinyl)methoxy]phenyl]methyl]-2,4-Thiazolidinedione
Balaglitazone [INN]2,4-Thiazolidinedione, 5-[[4-[(3,4-dihydro-3-methyl-4-oxo-2-quinazolinyl)methoxy]phenyl]methyl]-DRF 2593;NN 23445-(p-((3,4-Dihydro-3-methyl-4-oxo-2-quinazolinyl)methoxy)benzyl)-2,4-thiazolidinedioneBalaglitazone?5-(4-((3-methyl-4-oxo-3,4-dihydroquinazolin-2-yl)methoxy)benzyl)thiazolidine-2,4-dione5-[4-[[3-Methyl-4-oxo-3,4-dihydroquinazolin-2-yl]methoxy]benzyl]thiazolidine-2,4-dioneUNII-4M1609828O
Datenbank-Bezeichner
- CAS
199113-98-9- PubChem CID
- 9889200
- DTXSID
DTXSID30870213- ChEMBL
CHEMBL2103991- UNII
- 4M1609828O
- Nikkaji
- J2.770.563D
Eigenschaften
Berechnete StruktureigenschaftenWird ergänzt
- XLogP
- 2,7
- Polarare Oberfläche (TPSA)
- 113 Ų
- H-Brücken-Donoren
- 1
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 28
- Formalladung
- 0
- Komplexität
- 674
Physikochemische Eigenschaften
- Dichte
- 1.45 · 1.45±0.1 g/cm3(Predicted)
- storage temp.
- -20 °C · Inert atmosphere,Store in freezer, under -20°C
- Löslichkeit
- 2 O; · insoluble in H2O; ≥15.45 mg/mL in DMSO; ≥2.18 mg/mL in EtOH with gentle warming and ultrasonic
- Aggregatzustand
- solid
- pka
- 6.33 · 6.33±0.50(Predicted)
- Farbe
- Light yellow to yellow
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