ChemSpider 2D Image | N-{2-[(1H-Indol-2-ylcarbonyl)amino]benzoyl}-L-phenylalanine | C25H21N3O4

N-{2-[(1H-Indol-2-ylcarbonyl)amino]benzoyl}-L-phenylalanine

  • Molecular FormulaC25H21N3O4
  • Average mass427.452 Da
  • Monoisotopic mass427.153198 Da
  • ChemSpider ID24637079

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

L-Phenylalanine, N-[2-[(1H-indol-2-ylcarbonyl)amino]benzoyl]- [ACD/Index Name]
N-{2-[(1H-Indol-2-ylcarbonyl)amino]benzoyl}-L-phenylalanin [German] [ACD/IUPAC Name]
N-{2-[(1H-Indol-2-ylcarbonyl)amino]benzoyl}-L-phenylalanine [ACD/IUPAC Name]
N-{2-[(1H-Indol-2-ylcarbonyl)amino]benzoyl}-L-phénylalanine [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 660.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.1±3.0 kJ/mol
Flash Point: 353.3±31.5 °C
Index of Refraction: 1.717
Molar Refractivity: 122.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 3.42
ACD/LogD (pH 5.5): 1.53
ACD/BCF (pH 5.5): 2.80
ACD/KOC (pH 5.5): 19.44
ACD/LogD (pH 7.4): 0.02
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 111 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 69.5±3.0 dyne/cm
Molar Volume: 309.8±3.0 cm3

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