ChemSpider 2D Image | N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]-4-pentylbenzamide | C34H43N3O6

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

  • Molecular FormulaC34H43N3O6
  • Average mass589.722 Da
  • Monoisotopic mass589.315186 Da
  • ChemSpider ID3285125

More details:

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

Benzamide, N-[2-[(1,3-benzodioxol-5-ylmethyl)[(5-methyl-2-furanyl)methyl]amino]-2-oxoethyl]-N-[2-(4-morpholinyl)ethyl]-4-pentyl- [ACD/Index Name]
N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]-4-pentylbenzamid [German] [ACD/IUPAC Name]
N-(2-{(1,3-Benzodioxol-5-ylmethyl)[(5-methyl-2-furyl)methyl]amino}-2-oxoethyl)-N-[2-(4-morpholinyl)ethyl]-4-pentylbenzamide [ACD/IUPAC Name]
N-(2-{(1,3-Benzodioxol-5-ylméthyl)[(5-méthyl-2-furyl)méthyl]amino}-2-oxoéthyl)-N-[2-(4-morpholinyl)éthyl]-4-pentylbenzamide [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: 753.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.9±3.0 kJ/mol
Flash Point: 409.7±32.9 °C
Index of Refraction: 1.580
Molar Refractivity: 164.3±0.3 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 14
#Rule of 5 Violations: 2
ACD/LogP: 5.44
ACD/LogD (pH 5.5): 4.16
ACD/BCF (pH 5.5): 562.85
ACD/KOC (pH 5.5): 1956.35
ACD/LogD (pH 7.4): 4.91
ACD/BCF (pH 7.4): 3122.50
ACD/KOC (pH 7.4): 10853.21
Polar Surface Area: 85 Å2
Polarizability: 65.1±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 493.7±3.0 cm3

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