ChemSpider 2D Image | N-Acetylglycyl-N-[(2S)-4,4-difluoro-3-oxo-1,6-diphenyl-2-hexanyl]-L-valinamide | C27H33F2N3O4

N-Acetylglycyl-N-[(2S)-4,4-difluoro-3-oxo-1,6-diphenyl-2-hexanyl]-L-valinamide

  • Molecular FormulaC27H33F2N3O4
  • Average mass501.565 Da
  • Monoisotopic mass501.243927 Da
  • ChemSpider ID411355

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

L-Valinamide, N-acetylglycyl-N-[(1S)-3,3-difluoro-2-oxo-5-phenyl-1-(phenylmethyl)pentyl]- [ACD/Index Name]
N-Acetylglycyl-N-[(2S)-4,4-difluor-3-oxo-1,6-diphenyl-2-hexanyl]-L-valinamid [German] [ACD/IUPAC Name]
N-Acetylglycyl-N-[(2S)-4,4-difluoro-3-oxo-1,6-diphenyl-2-hexanyl]-L-valinamide [ACD/IUPAC Name]
N-Acétylglycyl-N-[(2S)-4,4-difluoro-3-oxo-1,6-diphényl-2-hexanyl]-L-valinamide [French] [ACD/IUPAC Name]
N-[N'-(Acetyl-glycinyl-L-valinyl)]-2-amino-4,4-difluoro-1,6-diphenyl-3-hexanone

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

AIDS058043 [DBID]
AIDS-058043 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 769.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.1±3.0 kJ/mol
Flash Point: 419.3±32.9 °C
Index of Refraction: 1.532
Molar Refractivity: 131.6±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 1
ACD/LogP: 4.86
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 95.48
ACD/KOC (pH 5.5): 909.54
ACD/LogD (pH 7.4): 2.91
ACD/BCF (pH 7.4): 95.48
ACD/KOC (pH 7.4): 909.53
Polar Surface Area: 104 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 42.4±3.0 dyne/cm
Molar Volume: 424.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement