ChemSpider 2D Image | 6-[(4-Chlorophenyl)(methoxy)(1-methyl-1H-imidazol-5-yl)methyl]-4-(2,6-difluorophenyl)-1-methyl-2(1H)-quinolinone | C28H22ClF2N3O2

6-[(4-Chlorophenyl)(methoxy)(1-methyl-1H-imidazol-5-yl)methyl]-4-(2,6-difluorophenyl)-1-methyl-2(1H)-quinolinone

  • Molecular FormulaC28H22ClF2N3O2
  • Average mass505.943 Da
  • Monoisotopic mass505.136871 Da
  • ChemSpider ID24671119

More details:






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

2(1H)-Quinolinone, 6-[(4-chlorophenyl)methoxy(1-methyl-1H-imidazol-5-yl)methyl]-4-(2,6-difluorophenyl)-1-methyl- [ACD/Index Name]
6-[(4-Chlorophényl)(méthoxy)(1-méthyl-1H-imidazol-5-yl)méthyl]-4-(2,6-difluorophényl)-1-méthyl-2(1H)-quinoléinone [French] [ACD/IUPAC Name]
6-[(4-Chlorophenyl)(methoxy)(1-methyl-1H-imidazol-5-yl)methyl]-4-(2,6-difluorophenyl)-1-methyl-2(1H)-quinolinone [ACD/IUPAC Name]
6-[(4-Chlorphenyl)(methoxy)(1-methyl-1H-imidazol-5-yl)methyl]-4-(2,6-difluorphenyl)-1-methyl-2(1H)-chinolinon [German] [ACD/IUPAC Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 621.4±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 329.6±31.5 °C
Index of Refraction: 1.620
Molar Refractivity: 136.4±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 5.93
ACD/LogD (pH 5.5): 4.88
ACD/BCF (pH 5.5): 1940.29
ACD/KOC (pH 5.5): 4630.81
ACD/LogD (pH 7.4): 5.66
ACD/BCF (pH 7.4): 11638.14
ACD/KOC (pH 7.4): 27776.28
Polar Surface Area: 47 Å2
Polarizability: 54.1±0.5 10-24cm3
Surface Tension: 43.3±7.0 dyne/cm
Molar Volume: 388.1±7.0 cm3

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