ChemSpider 2D Image | N-{[(2R,3S,4R,5S)-3,4-Dihydroxy-5-{2-oxo-2-[(3-pyridinylmethyl)amino]ethyl}tetrahydro-2-furanyl]methyl}-4-morpholinecarboxamide | C18H26N4O6

N-{[(2R,3S,4R,5S)-3,4-Dihydroxy-5-{2-oxo-2-[(3-pyridinylmethyl)amino]ethyl}tetrahydro-2-furanyl]methyl}-4-morpholinecarboxamide

  • Molecular FormulaC18H26N4O6
  • Average mass394.422 Da
  • Monoisotopic mass394.185242 Da
  • ChemSpider ID21387254

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

N-{[(2R,3S,4R,5S)-3,4-Dihydroxy-5-{2-oxo-2-[(3-pyridinylmethyl)amino]ethyl}tetrahydro-2-furanyl]methyl}-4-morpholincarboxamid [German] [ACD/IUPAC Name]
N-{[(2R,3S,4R,5S)-3,4-Dihydroxy-5-{2-oxo-2-[(3-pyridinylmethyl)amino]ethyl}tetrahydro-2-furanyl]methyl}-4-morpholinecarboxamide [ACD/IUPAC Name]
N-{[(2R,3S,4R,5S)-3,4-Dihydroxy-5-{2-oxo-2-[(3-pyridinylméthyl)amino]éthyl}tétrahydro-2-furanyl]méthyl}-4-morpholinecarboxamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 806.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 122.9±3.0 kJ/mol
Flash Point: 441.5±34.3 °C
Index of Refraction: 1.584
Molar Refractivity: 97.8±0.3 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: -2.33
ACD/LogD (pH 5.5): -1.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.13
ACD/LogD (pH 7.4): -1.31
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 4.62
Polar Surface Area: 133 Å2
Polarizability: 38.8±0.5 10-24cm3
Surface Tension: 62.2±3.0 dyne/cm
Molar Volume: 292.3±3.0 cm3

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