ChemSpider 2D Image | D-Phenylalanyl-N-(3-fluorobenzyl)-L-prolinamide | C21H24FN3O2

D-Phenylalanyl-N-(3-fluorobenzyl)-L-prolinamide

  • Molecular FormulaC21H24FN3O2
  • Average mass369.433 Da
  • Monoisotopic mass369.185242 Da
  • ChemSpider ID25058086

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

D-Phenylalanyl-N-(3-fluorbenzyl)-L-prolinamid [German] [ACD/IUPAC Name]
D-Phenylalanyl-N-(3-fluorobenzyl)-L-prolinamide [ACD/IUPAC Name]
D-Phénylalanyl-N-(3-fluorobenzyl)-L-prolinamide [French] [ACD/IUPAC Name]
L-Prolinamide, D-phenylalanyl-N-[(3-fluorophenyl)methyl]- [ACD/Index Name]
(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3-fluorophenyl)methyl]pyrrolidine-2-carboxamide
37U

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

Density: 1.2±0.1 g/cm3
Boiling Point: 630.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.3±3.0 kJ/mol
Flash Point: 335.2±31.5 °C
Index of Refraction: 1.596
Molar Refractivity: 101.1±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.39
ACD/LogD (pH 5.5): -0.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.09
ACD/LogD (pH 7.4): 1.59
ACD/BCF (pH 7.4): 7.17
ACD/KOC (pH 7.4): 101.78
Polar Surface Area: 75 Å2
Polarizability: 40.1±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 297.3±3.0 cm3

Click to predict properties on the Chemicalize site


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