ChemSpider 2D Image | (1R,6R)-1,4:3,6-Dianhydro-2-deoxy-6-{[(4-morpholinylcarbonyl)amino]methyl}-1-[2-oxo-2-(propylamino)ethyl]-D-arabino-hexitol | C17H29N3O6

(1R,6R)-1,4:3,6-Dianhydro-2-deoxy-6-{[(4-morpholinylcarbonyl)amino]methyl}-1-[2-oxo-2-(propylamino)ethyl]-D-arabino-hexitol

  • Molecular FormulaC17H29N3O6
  • Average mass371.429 Da
  • Monoisotopic mass371.205627 Da
  • ChemSpider ID65002744
  • defined stereocentres - 5 of 5 defined stereocentres


More details:






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

(1R,6R)-1,4:3,6-Dianhydro-2-deoxy-6-{[(4-morpholinylcarbonyl)amino]methyl}-1-[2-oxo-2-(propylamino)ethyl]-D-arabino-hexitol [ACD/IUPAC Name]
(1R,6R)-1,4:3,6-Dianhydro-2-desoxy-6-{[(4-morpholinylcarbonyl)amino]methyl}-1-[2-oxo-2-(propylamino)ethyl]-D-arabino-hexitol [German] [ACD/IUPAC Name]
(1R,6R)-1,4:3,6-Dianhydro-2-désoxy-6-{[(4-morpholinylcarbonyl)amino]méthyl}-1-[2-oxo-2-(propylamino)éthyl]-D-arabino-hexitol [French] [ACD/IUPAC Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 709.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±5.1 mmHg at 25°C
Enthalpy of Vaporization: 118.6±6.0 kJ/mol
Flash Point: 383.0±32.9 °C
Index of Refraction: 1.525
Molar Refractivity: 91.8±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -1.59
ACD/LogD (pH 5.5): -0.62
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 10.97
ACD/LogD (pH 7.4): -0.62
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 10.97
Polar Surface Area: 109 Å2
Polarizability: 36.4±0.5 10-24cm3
Surface Tension: 46.7±3.0 dyne/cm
Molar Volume: 299.7±3.0 cm3

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