ChemSpider 2D Image | 3-[(1-Ethyl-5-fluoro-1H-benzimidazol-2-yl)methyl]-7-fluoro-4(3H)-quinazolinone | C18H14F2N4O

3-[(1-Ethyl-5-fluoro-1H-benzimidazol-2-yl)methyl]-7-fluoro-4(3H)-quinazolinone

  • Molecular FormulaC18H14F2N4O
  • Average mass340.327 Da
  • Monoisotopic mass340.113556 Da
  • ChemSpider ID30305284

More details:

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

3-[(1-Ethyl-5-fluor-1H-benzimidazol-2-yl)methyl]-7-fluor-4(3H)-chinazolinon [German] [ACD/IUPAC Name]
3-[(1-Ethyl-5-fluoro-1H-benzimidazol-2-yl)methyl]-7-fluoro-4(3H)-quinazolinone [ACD/IUPAC Name]
3-[(1-Éthyl-5-fluoro-1H-benzimidazol-2-yl)méthyl]-7-fluoro-4(3H)-quinazolinone [French] [ACD/IUPAC Name]
4(3H)-Quinazolinone, 3-[(1-ethyl-5-fluoro-1H-benzimidazol-2-yl)methyl]-7-fluoro- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 550.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.5 mmHg at 25°C
Enthalpy of Vaporization: 83.0±3.0 kJ/mol
Flash Point: 286.7±32.9 °C
Index of Refraction: 1.666
Molar Refractivity: 89.7±0.5 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 3.24
ACD/LogD (pH 5.5): 2.78
ACD/BCF (pH 5.5): 73.59
ACD/KOC (pH 5.5): 730.43
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 82.49
ACD/KOC (pH 7.4): 818.79
Polar Surface Area: 50 Å2
Polarizability: 35.6±0.5 10-24cm3
Surface Tension: 48.2±7.0 dyne/cm
Molar Volume: 241.5±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement