ChemSpider 2D Image | N-Methyl-Nalpha-[(2-methyl-1H-indol-3-yl)acetyl]-N-phenyl-L-phenylalaninamide | C27H27N3O2

N-Methyl-Nα-[(2-methyl-1H-indol-3-yl)acetyl]-N-phenyl-L-phenylalaninamide

  • Molecular FormulaC27H27N3O2
  • Average mass425.522 Da
  • Monoisotopic mass425.210327 Da
  • ChemSpider ID25060748
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

1H-Indole-3-acetamide, 2-methyl-N-[(1S)-2-(methylphenylamino)-2-oxo-1-(phenylmethyl)ethyl]- [ACD/Index Name]
N-Methyl-Nα-[(2-methyl-1H-indol-3-yl)acetyl]-N-phenyl-L-phenylalaninamid [German] [ACD/IUPAC Name]
N-Methyl-Nα-[(2-methyl-1H-indol-3-yl)acetyl]-N-phenyl-L-phenylalaninamide [ACD/IUPAC Name]
N-Méthyl-Nα-[2-(2-méthyl-1H-indol-3-yl)acétyl]-N-phényl-L-phénylalaninamide [French] [ACD/IUPAC Name]
[1352879-65-2]
1352879-65-2 [RN]
1B0
MFCD28160729
PF3450074
PF-3450074

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.2±0.1 g/cm3
Boiling Point: 704.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.1±3.0 kJ/mol
Flash Point: 380.1±32.9 °C
Index of Refraction: 1.664
Molar Refractivity: 128.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 3.98
ACD/BCF (pH 5.5): 625.56
ACD/KOC (pH 5.5): 3492.79
ACD/LogD (pH 7.4): 3.98
ACD/BCF (pH 7.4): 625.57
ACD/KOC (pH 7.4): 3492.82
Polar Surface Area: 65 Å2
Polarizability: 51.1±0.5 10-24cm3
Surface Tension: 56.0±3.0 dyne/cm
Molar Volume: 347.0±3.0 cm3

Click to predict properties on the Chemicalize site






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