ChemSpider 2D Image | N~2~-(Trifluoroacetyl)-L-lysyl-N-(4-isopropylphenyl)-L-phenylalaninamide | C26H33F3N4O3

N2-(Trifluoroacetyl)-L-lysyl-N-(4-isopropylphenyl)-L-phenylalaninamide

  • Molecular FormulaC26H33F3N4O3
  • Average mass506.560 Da
  • Monoisotopic mass506.250488 Da
  • ChemSpider ID393023

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Phenylalaninamide, N2-(2,2,2-trifluoroacetyl)-L-lysyl-N-[4-(1-methylethyl)phenyl]- [ACD/Index Name]
N2-(2,2,2-Trifluoroacétyl)-L-lysyl-N-(4-isopropylphényl)-L-phénylalaninamide [French] [ACD/IUPAC Name]
N2-(Trifluoracetyl)-L-lysyl-N-(4-isopropylphenyl)-L-phenylalaninamid [German] [ACD/IUPAC Name]
N2-(Trifluoroacetyl)-L-lysyl-N-(4-isopropylphenyl)-L-phenylalaninamide [ACD/IUPAC Name]
0Z3
6-Ammonio-N-(Trifluoroacetyl)-L-Norleucyl-N-[4-(1-Methylethyl)phenyl]-L-Phenylalaninamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 731.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.8±3.0 kJ/mol
Flash Point: 396.4±32.9 °C
Index of Refraction: 1.550
Molar Refractivity: 132.1±0.3 cm3
#H bond acceptors: 7
#H bond donors: 5
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 3
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.89
ACD/LogD (pH 7.4): 0.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.37
Polar Surface Area: 113 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 44.3±3.0 dyne/cm
Molar Volume: 414.5±3.0 cm3

Click to predict properties on the Chemicalize site


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