Grundinformationen
- Standard-SMILES
CCCc1nn(C)c(C(N)=O)c1NC(=O)c1ccccc1OCC- InChIKey
UAFIHVRUICMADE-UHFFFAOYSA-N- Summenformel
- C17H22N4O3
- Durchschnittliche Molmasse
- 330,4 g/mol
- Monoisotopische Masse
- 330,16919056
Namen und Bezeichner
- Bevorzugter Name
- 4-(2-Ethoxybenzamido)-1-methyl-3-propylpyrazole-5-carboxamide
- IUPAC
- 4-[(2-ethoxybenzoyl)amino]-1-methyl-3-propylpyrazole-5-carboxamide
- Englischer Name
- 4-(2-Ethoxy benzamido)-1-methyl-3-n-propyl pyrazole-5-carboxamide.
- Summenformel
- C17H22N4O3
- Molmasse
- 330.38
Namen und Synonyme
139756-03-9Sildenafil di-amide impuritySildenafil carboxamide impurity8M7KI0WTIA4-(2-Ethoxybenzamido)-1-methyl-3-propylpyrazole-5-carboxamide1H-Pyrazole-5-carboxamide, 4-((2-ethoxybenzoyl)amino)-1-methyl-3-propyl-4-((2-Ethoxybenzoyl)amino)-1-methyl-3-propyl-1H-pyrazole-5-carboxamide4-[(2-ethoxybenzoyl)amino]-1-methyl-3-propyl-1H-pyrazole-5-carboxamide1H-Pyrazole-5-carboxamide, 4-[(2-ethoxybenzoyl)amino]-1-methyl-3-propyl-RefChem:10698214-(2-ethoxybenzamido)-1-methyl-3-propyl-1H-pyrazole-5-carboxamide4-(2-Ethoxybenzamido)-1-methyl-3-n-propylpyrazole-5-carboxamide
Weitere Namen anzeigen
4-[(2-Ethoxybenzoyl)aMino]-1-Methyl-3-propyl-4-(2-Ethoxybenzaini do) -1 -methyl-3-n-pro pylpyrazole-5-carboxaniide7-chloro-5-(2-ethoxyphenyl)-1-methyl-3-propyl-1H-pyrazolo[4,3-d]pyrimidine
UNII-8M7KI0WTIA4-[(2-ethoxybenzoyl)amino]-2-methyl-5-propylpyrazole-3-carboxamide4-(2-Ethoxybenzoylamino)-1-methyl-3-propyl-1H-pyrazole-5-carboxamide4-(2-ETHOXY BENZAMIDO)-1-METHYL-3-N-PROPYL PYRAZOLE-5-CARBOXAMIDE.Sildenafil Impurity 111H-Pyrazole-5-carboxamide, 4-[(2-ethoxybenzoyl)amino]-1-methyl-3-propyl-; 4-[(2-Ethoxybenzoyl)amino]-1-methyl-3-propyl-1H-pyrazole-5-carboxamide; 4-(2-Ethoxybenzamido)-1-methyl-3-propylpyrazole-5-carboxamide; 4-(2-Ethoxybenzoylamino)-1-methyl-3-propyl-1H-pyrazole-5-carboxamideSCHEMBL1792Oprea1_191426
Datenbank-Bezeichner
- CAS
139756-03-9- PubChem CID
- 850135
- DTXSID
DTXSID40357308- UNII
- 8M7KI0WTIA
- Nikkaji
- J1.557.987K
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 2,4
- Polarare Oberfläche (TPSA)
- 99,2 Ų
- H-Brücken-Donoren
- 2
- H-Brücken-Akzeptoren
- 4
- Frei drehbare Bindungen
- 7
- Schwere Atome
- 24
- Formalladung
- 0
- Komplexität
- 446
Physikochemische Eigenschaften
- Schmelzpunkt
- 153 · 153-155 °C
- Siedepunkt
- 445.5 · 445.5±45.0 °C(Predicted)
- Dichte
- 1.24 · 1.24±0.1 g/cm3(Predicted)
- storage temp.
- Refrigerator
- Löslichkeit
- DMSO (Slightly), Methanol (Slightly)
- Aggregatzustand
- Solid
- pka
- 12.65 · 12.65±0.70(Predicted)
- Farbe
- White to Off-White
Chemie und Industrie
Anwendungen
VerwendenAn impurity of Sildenafil (S435000) (impurity C).
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