ChemSpider 2D Image | D-Phenylalanyl-N-(3-chlorobenzyl)-L-prolinamide | C21H24ClN3O2

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

  • Molecular FormulaC21H24ClN3O2
  • Average mass385.887 Da
  • Monoisotopic mass385.155701 Da
  • ChemSpider ID23188426
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

D-Phenylalanyl-N-(3-chlorbenzyl)-L-prolinamid [German] [ACD/IUPAC Name]
D-Phenylalanyl-N-(3-chlorobenzyl)-L-prolinamide [ACD/IUPAC Name]
D-Phénylalanyl-N-(3-chlorobenzyl)-L-prolinamide [French] [ACD/IUPAC Name]
L-Prolinamide, D-phenylalanyl-N-[(3-chlorophenyl)methyl]- [ACD/Index Name]
(2S)-1-[(2R)-2-amino-3-phenylpropanoyl]-N-[(3-chlorophenyl)methyl]pyrrolidine-2-carboxamide
(S)-1-((R)-2-Amino-3-phenyl-propionyl)-pyrrolidine-2-carboxylic acid 3-chloro-benzylamide
1-((S)-2-Amino-1-(R)-oxo-3-phenyl-propyl)-pyrrolidine-2-carboxylic acid 3-chloro-benzylamide
22U
628262-82-8 [RN]
CHEMBL321130
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Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.3±0.1 g/cm3
Boiling Point: 653.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.3±3.0 kJ/mol
Flash Point: 349.1±31.5 °C
Index of Refraction: 1.612
Molar Refractivity: 106.0±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.94
ACD/LogD (pH 5.5): 0.52
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.56
ACD/LogD (pH 7.4): 2.21
ACD/BCF (pH 7.4): 21.26
ACD/KOC (pH 7.4): 221.54
Polar Surface Area: 75 Å2
Polarizability: 42.0±0.5 10-24cm3
Surface Tension: 56.5±3.0 dyne/cm
Molar Volume: 305.0±3.0 cm3

Click to predict properties on the Chemicalize site






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