ChemSpider 2D Image | Nalpha-[(Benzyloxy)carbonyl]-N-[1-(2,3,5-tri-O-acetyl-beta-D-ribofuranosyl)-1H-imidazol-4-yl]-L-phenylalaninamide | C31H34N4O10

Nα-[(Benzyloxy)carbonyl]-N-[1-(2,3,5-tri-O-acetyl-β-D-ribofuranosyl)-1H-imidazol-4-yl]-L-phenylalaninamide

  • Molecular FormulaC31H34N4O10
  • Average mass622.622 Da
  • Monoisotopic mass622.227478 Da
  • ChemSpider ID9332975

  • defined stereocentres - 5 of 5 defined stereocentres

More details:

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

1H-Imidazol-4-amine, N-[(2S)-1-oxo-3-phenyl-2-[[(phenylmethoxy)carbonyl]amino]propyl]-1-(2,3,5-tri-O-acetyl-β-D-ribofuranosyl)- [ACD/Index Name]
Nα-[(Benzyloxy)carbonyl]-N-[1-(2,3,5-tri-O-acetyl-β-D-ribofuranosyl)-1H-imidazol-4-yl]-L-phenylalaninamid [German] [ACD/IUPAC Name]
Nα-[(Benzyloxy)carbonyl]-N-[1-(2,3,5-tri-O-acetyl-β-D-ribofuranosyl)-1H-imidazol-4-yl]-L-phenylalaninamide [ACD/IUPAC Name]
Nα-[(Benzyloxy)carbonyl]-N-[1-(2,3,5-tri-O-acétyl-β-D-ribofuranosyl)-1H-imidazol-4-yl]-L-phénylalaninamide [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: 852.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.2 mmHg at 25°C
Enthalpy of Vaporization: 123.8±3.0 kJ/mol
Flash Point: 469.2±34.3 °C
Index of Refraction: 1.612
Molar Refractivity: 159.0±0.5 cm3
#H bond acceptors: 14
#H bond donors: 2
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 4.90
ACD/LogD (pH 5.5): 3.55
ACD/BCF (pH 5.5): 281.76
ACD/KOC (pH 5.5): 1897.92
ACD/LogD (pH 7.4): 3.60
ACD/BCF (pH 7.4): 322.49
ACD/KOC (pH 7.4): 2172.29
Polar Surface Area: 173 Å2
Polarizability: 63.0±0.5 10-24cm3
Surface Tension: 51.7±7.0 dyne/cm
Molar Volume: 457.6±7.0 cm3

Click to predict properties on the Chemicalize site


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