ChemSpider 2D Image | N-(4-Bromo-2-fluorophenyl)-4-fluoro-Nalpha-[(5-methyl-2-furyl)acetyl]phenylalaninamide | C22H19BrF2N2O3

N-(4-Bromo-2-fluorophenyl)-4-fluoro-Nα-[(5-methyl-2-furyl)acetyl]phenylalaninamide

  • Molecular FormulaC22H19BrF2N2O3
  • Average mass477.299 Da
  • Monoisotopic mass476.054718 Da
  • ChemSpider ID120978530

More details:

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

2-Furanacetamide, N-[2-[(4-bromo-2-fluorophenyl)amino]-1-[(4-fluorophenyl)methyl]-2-oxoethyl]-5-methyl- [ACD/Index Name]
N-(4-Brom-2-fluorphenyl)-4-fluor-Nα-[(5-methyl-2-furyl)acetyl]phenylalaninamid [German] [ACD/IUPAC Name]
N-(4-Bromo-2-fluorophenyl)-4-fluoro-Nα-[(5-methyl-2-furyl)acetyl]phenylalaninamide [ACD/IUPAC Name]
N-(4-Bromo-2-fluorophényl)-4-fluoro-Nα-[2-(5-méthyl-2-furyl)acétyl]phénylalaninamide [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 675.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 362.4±31.5 °C
Index of Refraction: 1.608
Molar Refractivity: 111.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 4.12
ACD/BCF (pH 5.5): 793.99
ACD/KOC (pH 5.5): 4142.77
ACD/LogD (pH 7.4): 4.12
ACD/BCF (pH 7.4): 793.92
ACD/KOC (pH 7.4): 4142.40
Polar Surface Area: 71 Å2
Polarizability: 44.3±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 323.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement