CV-15959
Grundinformationen
- CAS
168434-02-4- Standard-SMILES
O=C(O)c1cccc2[nH]c(=O)n(Cc3ccc(-c4ccccc4-c4nn[nH]n4)cc3)c12- InChIKey
KLCPKPIDOPBIQW-UHFFFAOYSA-N- Summenformel
- C22H16N6O3
- Durchschnittliche Molmasse
- 412,4 g/mol
- Monoisotopische Masse
- 412,12838839
Überblick
O-desethyl candesartan is a benzimidazolecarboxylic acid that is candesartan in which the ethoxy group has been replaced by a hydroxy group. It is the inactive metabolite of the anti-hypertensive drug, candesartan. It has a role as a drug metabolite, a human urinary metabolite and a human blood serum metabolite. It is a benzimidazolecarboxylic acid and a biphenylyltetrazole.
Namen und Bezeichner
- Bevorzugter Name
- CV-15959
- IUPAC
- 2-oxo-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-benzimidazole-4-carboxylic acid
- Englischer Name
- CV 15959
- Summenformel
- C22H16N6O3
- Molmasse
- 412.4
Namen und Synonyme
O-Desethyl Candesartan168434-02-4CV-15959CV 15959RMN65A337Y2-oxo-3-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-1H-benzimidazole-4-carboxylic acid1H-Benzimidazole-4-carboxylic acid, 2,3-dihydro-2-oxo-3-((2'-(2H-tetrazol-5-yl)(1,1'-biphenyl)-4-yl)methyl)-CHEBI:1452241H-Benzimidazole-4-carboxylic acid, 2,3-dihydro-2-oxo-3-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]methyl]-2-oxo-3-((4-(2-(2H-tetrazol-5-yl)phenyl)phenyl)methyl)-1H-benzimidazole-4-carboxylic acidRefChem:1082341UNII-RMN65A337Y
Weitere Namen anzeigen
Candesartan O-Desethyl AnalogCandesartan Cilexetil ImpurityCandesartan Cilexetil Impurity 112,3-Dihydro-2-oxo-3-[[2'-(2H-tetrazol-5-yl)[1,1'-biphenyl]-4-yl]Methyl]-1H-benziMidazole-4-carboxylic Acid2,3-Dihydro-2-oxo-3-[[2'-(1H-tetrazol-5-yl)[1,1'-biphenyl]- 4-yl]Methyl]-1H-benziMidazole-4-carboxylic Acid
Candesartan Cilexetil Impurity 483-((2'-(1H-tetrazol-5-yl)-[1,1'-biphenyl]-4-yl)methyl)-2-oxo-2,3-dihydro-1H-benzo[d]imidazole-4-carboxylic acidO-DesethylcandesartanCandesartan impurity 4Candesartan Desethyl Analogorb3217049SCHEMBL4935797SCHEMBL31554980
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,6
- Polarare Oberfläche (TPSA)
- 124 Ų
- H-Brücken-Donoren
- 3
- H-Brücken-Akzeptoren
- 6
- Frei drehbare Bindungen
- 5
- Schwere Atome
- 31
- Formalladung
- 0
- Komplexität
- 670
Experimentelle und physikochemische Eigenschaften
DrugsPharmaceuticals -> Metabolite of Candesartan cilexetil
Physikochemische Eigenschaften
- Schmelzpunkt
- 257 °C · >257°C (dec.)
- Dichte
- 1.464 · 1.464±0.06 g/cm3(Predicted)
- storage temp.
- Refrigerator
- Löslichkeit
- DMSO (Slightly, Sonicated), Methanol (Slightly, Heated, Sonicated)
- pka
- 3.75 · 3.75±0.20(Predicted)
- Aggregatzustand
- Solid
- Farbe
- White to Pale Beige
Chemie und Industrie
Pharmakologische Informationen
Tissue LocationsKidney
Cellular LocationsExtracellular
Anwendungen
VerwendenO-Desethyl Candesartan is a metabolite of Candesartan (C175575) in human blood plasma and urine.
Anbieter26 Anbieter
济南百隆化学有限公司[email protected] · [email protected]
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普善实业（陕西）有限公司029-81310890 18165209495 · [email protected]
Guangzhou Tosun Pharmaceutical Limited+86-18124244216 +86-18124244216 · [email protected]
安耐吉化学&3A（安徽泽升科技有限公司）021-58432009 400-005-6266 · [email protected]
希瓦生物科技（广州）有限公司13268215580 · [email protected]
上海尺水药物研究有限公司[email protected] 13564957716 · [email protected]
BOC Sciences1-631-485-4226; 16314854226 · [email protected]
Moxin Chemicals+86-17320513646 +86-17320513646 · [email protected]
深圳振强药物研发有限公司
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