ChemSpider 2D Image | N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]heptanamide | C29H41N3O6

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

  • Molecular FormulaC29H41N3O6
  • Average mass527.652 Da
  • Monoisotopic mass527.299561 Da
  • ChemSpider ID3290593

More details:

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

Heptanamide, N-[2-[(1,3-benzodioxol-5-ylmethyl)[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-N-[2-(4-morpholinyl)ethyl]- [ACD/Index Name]
N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]heptanamid [German] [ACD/IUPAC Name]
N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]heptanamide [ACD/IUPAC Name]
N-(2-{(1,3-Benzodioxol-5-ylméthyl)[(5-méthyl-2-furyl)méthyl]amino}-2-oxoéthyl)-N-[2-(4-morpholinyl)éthyl]heptanamide [French] [ACD/IUPAC 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: 683.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.3±3.0 kJ/mol
Flash Point: 367.2±31.5 °C
Index of Refraction: 1.554
Molar Refractivity: 143.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 1
ACD/LogP: 4.33
ACD/LogD (pH 5.5): 2.99
ACD/BCF (pH 5.5): 69.60
ACD/KOC (pH 5.5): 419.51
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 444.81
ACD/KOC (pH 7.4): 2681.24
Polar Surface Area: 85 Å2
Polarizability: 57.0±0.5 10-24cm3
Surface Tension: 48.1±3.0 dyne/cm
Molar Volume: 448.1±3.0 cm3

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