ChemSpider 2D Image | beta-phenyl-D-phenylalanyl-N-propyl-L-prolinamide | C23H29N3O2

β-phenyl-D-phenylalanyl-N-propyl-L-prolinamide

  • Molecular FormulaC23H29N3O2
  • Average mass379.495 Da
  • Monoisotopic mass379.225983 Da
  • ChemSpider ID23338407

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

β-Phenyl-D-phenylalanyl-N-propyl-L-prolinamid [German] [ACD/IUPAC Name]
β-phenyl-D-phenylalanyl-N-propyl-L-prolinamide [ACD/IUPAC Name]
β-Phényl-D-phénylalanyl-N-propyl-L-prolinamide [French] [ACD/IUPAC Name]
(2S)-1-[(2R)-2-amino-3,3-diphenylpropanoyl]-N-propylpyrrolidine-2-carboxamide
(S)-1-((R)-2-amino-3,3-diphenylpropanoyl)-N-propylpyrrolidine-2-carboxamide
44U
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL490730/
L-prolinamide, β-phenyl-D-phenylalanyl-N-propyl- [ACD/Index Name]
proline scaffold, 26

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

Density: 1.2±0.1 g/cm3
Boiling Point: 631.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 93.4±3.0 kJ/mol
Flash Point: 335.6±31.5 °C
Index of Refraction: 1.585
Molar Refractivity: 110.3±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.40
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 1.50
ACD/KOC (pH 5.5): 17.18
ACD/LogD (pH 7.4): 2.39
ACD/BCF (pH 7.4): 35.35
ACD/KOC (pH 7.4): 404.36
Polar Surface Area: 75 Å2
Polarizability: 43.7±0.5 10-24cm3
Surface Tension: 50.4±3.0 dyne/cm
Molar Volume: 329.2±3.0 cm3

Click to predict properties on the Chemicalize site


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