ChemSpider 2D Image | N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]nonanamide | C31H45N3O6

N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]nonanamide

  • Molecular FormulaC31H45N3O6
  • Average mass555.706 Da
  • Monoisotopic mass555.330811 Da
  • ChemSpider ID3290594

More details:

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

N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]nonanamid [German] [ACD/IUPAC Name]
N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]nonanamide [ACD/IUPAC Name]
N-(2-{(1,3-Benzodioxol-5-ylméthyl)[(5-méthyl-2-furyl)méthyl]amino}-2-oxoéthyl)-N-[2-(4-morpholinyl)éthyl]nonanamide [French] [ACD/IUPAC Name]
Nonanamide, N-[2-[(1,3-benzodioxol-5-ylmethyl)[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-N-[2-(4-morpholinyl)ethyl]- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 700.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.5±3.0 kJ/mol
Flash Point: 377.3±32.9 °C
Index of Refraction: 1.549
Molar Refractivity: 152.9±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 16
#Rule of 5 Violations: 2
ACD/LogP: 5.39
ACD/LogD (pH 5.5): 4.05
ACD/BCF (pH 5.5): 447.28
ACD/KOC (pH 5.5): 1593.36
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 2832.97
ACD/KOC (pH 7.4): 10091.96
Polar Surface Area: 85 Å2
Polarizability: 60.6±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 481.1±3.0 cm3

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