ChemSpider 2D Image | 5-[3-Ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one | C33H37N3O7

5-[3-Ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one

  • Molecular FormulaC33H37N3O7
  • Average mass587.663 Da
  • Monoisotopic mass587.263123 Da
  • ChemSpider ID4049817

More details:

Validated by Experts, Validated by Users, Non-Validated, Removed by Users

2H-Pyrrol-2-one, 5-[3-ethoxy-4-(pentyloxy)phenyl]-1,5-dihydro-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(7-methoxy-2-benzofuranyl)carbonyl]- [ACD/Index Name]
5-[3-Ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-on [German] [ACD/IUPAC Name]
5-[3-Ethoxy-4-(pentyloxy)phenyl]-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(7-methoxy-1-benzofuran-2-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one [ACD/IUPAC Name]
5-[3-Éthoxy-4-(pentyloxy)phényl]-3-hydroxy-1-[3-(1H-imidazol-1-yl)propyl]-4-[(7-méthoxy-1-benzofuran-2-yl)carbonyl]-1,5-dihydro-2H-pyrrol-2-one [French] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 789.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 120.5±3.0 kJ/mol
Flash Point: 431.4±32.9 °C
Index of Refraction: 1.612
Molar Refractivity: 160.4±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 15
#Rule of 5 Violations: 3
ACD/LogP: 5.10
ACD/LogD (pH 5.5): 2.18
ACD/BCF (pH 5.5): 7.78
ACD/KOC (pH 5.5): 35.36
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 2.59
ACD/KOC (pH 7.4): 11.78
Polar Surface Area: 116 Å2
Polarizability: 63.6±0.5 10-24cm3
Surface Tension: 47.7±7.0 dyne/cm
Molar Volume: 461.7±7.0 cm3

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