ChemSpider 2D Image | 2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({[(4-methylphenyl)carbamoyl]amino}methyl)tetrahydro-2-furanyl]-N-[2-(4-morpholinyl)ethyl]acetamide | C21H32N4O6

2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({[(4-methylphenyl)carbamoyl]amino}methyl)tetrahydro-2-furanyl]-N-[2-(4-morpholinyl)ethyl]acetamide

  • Molecular FormulaC21H32N4O6
  • Average mass436.502 Da
  • Monoisotopic mass436.232178 Da
  • ChemSpider ID21387075

  • defined stereocentres - 4 of 4 defined stereocentres

More details:

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

2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({[(4-methylphenyl)carbamoyl]amino}methyl)tetrahydro-2-furanyl]-N-[2-(4-morpholinyl)ethyl]acetamid [German] [ACD/IUPAC Name]
2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({[(4-methylphenyl)carbamoyl]amino}methyl)tetrahydro-2-furanyl]-N-[2-(4-morpholinyl)ethyl]acetamide [ACD/IUPAC Name]
2-[(2S,3R,4S,5R)-3,4-Dihydroxy-5-({[(4-méthylphényl)carbamoyl]amino}méthyl)tétrahydro-2-furanyl]-N-[2-(4-morpholinyl)éthyl]acétamide [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: 699.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.5±3.0 kJ/mol
Flash Point: 376.8±31.5 °C
Index of Refraction: 1.589
Molar Refractivity: 114.0±0.3 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: -0.79
ACD/LogD (pH 5.5): -1.56
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.43
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.84
Polar Surface Area: 132 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 57.5±3.0 dyne/cm
Molar Volume: 338.5±3.0 cm3

Click to predict properties on the Chemicalize site


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