ChemSpider 2D Image | 1-{[1-(3,4-Difluorobenzyl)-1H-imidazol-2-yl]methyl}-3-(2-methyl-2-propanyl)-1-(tetrahydro-2-furanylmethyl)urea | C21H28F2N4O2

1-{[1-(3,4-Difluorobenzyl)-1H-imidazol-2-yl]methyl}-3-(2-methyl-2-propanyl)-1-(tetrahydro-2-furanylmethyl)urea

  • Molecular FormulaC21H28F2N4O2
  • Average mass406.469 Da
  • Monoisotopic mass406.218048 Da
  • ChemSpider ID21554137

More details:

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

1-{[1-(3,4-Difluorbenzyl)-1H-imidazol-2-yl]methyl}-3-(2-methyl-2-propanyl)-1-(tetrahydro-2-furanylmethyl)harnstoff [German] [ACD/IUPAC Name]
1-{[1-(3,4-Difluorobenzyl)-1H-imidazol-2-yl]methyl}-3-(2-methyl-2-propanyl)-1-(tetrahydro-2-furanylmethyl)urea [ACD/IUPAC Name]
1-{[1-(3,4-Difluorobenzyl)-1H-imidazol-2-yl]méthyl}-3-(2-méthyl-2-propanyl)-1-(tétrahydro-2-furanylméthyl)urée [French] [ACD/IUPAC Name]
Urea, N-[[1-[(3,4-difluorophenyl)methyl]-1H-imidazol-2-yl]methyl]-N'-(1,1-dimethylethyl)-N-[(tetrahydro-2-furanyl)methyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 587.3±45.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.7±3.0 kJ/mol
Flash Point: 309.0±28.7 °C
Index of Refraction: 1.570
Molar Refractivity: 107.7±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.84
ACD/LogD (pH 5.5): 2.82
ACD/BCF (pH 5.5): 50.72
ACD/KOC (pH 5.5): 329.94
ACD/LogD (pH 7.4): 3.64
ACD/BCF (pH 7.4): 338.37
ACD/KOC (pH 7.4): 2201.34
Polar Surface Area: 59 Å2
Polarizability: 42.7±0.5 10-24cm3
Surface Tension: 40.1±7.0 dyne/cm
Molar Volume: 328.3±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement