ChemSpider 2D Image | Nalpha-(2-Chloro-6-fluorobenzoyl)-N-[cyclopropyl(3,4-difluorophenyl)methyl]tyrosinamide | C26H22ClF3N2O3

Nα-(2-Chloro-6-fluorobenzoyl)-N-[cyclopropyl(3,4-difluorophenyl)methyl]tyrosinamide

  • Molecular FormulaC26H22ClF3N2O3
  • Average mass502.913 Da
  • Monoisotopic mass502.127106 Da
  • ChemSpider ID121234130

More details:

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

Benzenepropanamide, α-[(2-chloro-6-fluorobenzoyl)amino]-N-[cyclopropyl(3,4-difluorophenyl)methyl]-4-hydroxy- [ACD/Index Name]
Nα-(2-Chlor-6-fluorbenzoyl)-N-[cyclopropyl(3,4-difluorphenyl)methyl]tyrosinamid [German] [ACD/IUPAC Name]
Nα-(2-Chloro-6-fluorobenzoyl)-N-[cyclopropyl(3,4-difluorophenyl)methyl]tyrosinamide [ACD/IUPAC Name]
Nα-(2-Chloro-6-fluorobenzoyl)-N-[cyclopropyl(3,4-difluorophényl)méthyl]tyrosinamide [French] [ACD/IUPAC 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: 699.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 106.1±3.0 kJ/mol
Flash Point: 377.1±31.5 °C
Index of Refraction: 1.618
Molar Refractivity: 124.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 3.32
ACD/LogD (pH 5.5): 3.53
ACD/BCF (pH 5.5): 281.68
ACD/KOC (pH 5.5): 1973.03
ACD/LogD (pH 7.4): 3.52
ACD/BCF (pH 7.4): 280.66
ACD/KOC (pH 7.4): 1965.89
Polar Surface Area: 78 Å2
Polarizability: 49.5±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 356.6±3.0 cm3

Click to predict properties on the Chemicalize site


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