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Search term: XSOBNETYEYXSCD-MOPGFXCFSA-N (Found by InChIKey (full match))
ChemSpider 2D Image | D-Phenylalanyl-N-(2,5-dichlorobenzyl)-L-prolinamide | C21H23Cl2N3O2

D-Phenylalanyl-N-(2,5-dichlorobenzyl)-L-prolinamide

  • Molecular FormulaC21H23Cl2N3O2
  • Average mass420.332 Da
  • Monoisotopic mass419.116730 Da
  • ChemSpider ID28666905

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

D-Phenylalanyl-N-(2,5-dichlorbenzyl)-L-prolinamid [German] [ACD/IUPAC Name]
D-Phenylalanyl-N-(2,5-dichlorobenzyl)-L-prolinamide [ACD/IUPAC Name]
D-Phénylalanyl-N-(2,5-dichlorobenzyl)-L-prolinamide [French] [ACD/IUPAC Name]
L-Prolinamide, D-phenylalanyl-N-[(2,5-dichlorophenyl)methyl]- [ACD/Index Name]
N6L

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

Density: 1.3±0.1 g/cm3
Boiling Point: 670.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.5±3.0 kJ/mol
Flash Point: 359.3±31.5 °C
Index of Refraction: 1.617
Molar Refractivity: 110.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.46
ACD/LogD (pH 5.5): 1.16
ACD/BCF (pH 5.5): 1.34
ACD/KOC (pH 5.5): 10.15
ACD/LogD (pH 7.4): 2.85
ACD/BCF (pH 7.4): 65.08
ACD/KOC (pH 7.4): 493.46
Polar Surface Area: 75 Å2
Polarizability: 44.0±0.5 10-24cm3
Surface Tension: 57.7±3.0 dyne/cm
Molar Volume: 317.0±3.0 cm3

Click to predict properties on the Chemicalize site


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