ChemSpider 2D Image | 3,6-Dichloro-N-{1-[2-(4-ethylphenyl)-4-morpholinyl]-3-(4-fluorophenyl)-1-oxo-2-propanyl}-2-methoxybenzamide | C29H29Cl2FN2O4

3,6-Dichloro-N-{1-[2-(4-ethylphenyl)-4-morpholinyl]-3-(4-fluorophenyl)-1-oxo-2-propanyl}-2-methoxybenzamide

  • Molecular FormulaC29H29Cl2FN2O4
  • Average mass559.456 Da
  • Monoisotopic mass558.148865 Da
  • ChemSpider ID122297857

More details:

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

3,6-Dichlor-N-{1-[2-(4-ethylphenyl)-4-morpholinyl]-3-(4-fluorphenyl)-1-oxo-2-propanyl}-2-methoxybenzamid [German] [ACD/IUPAC Name]
3,6-Dichloro-N-{1-[2-(4-ethylphenyl)-4-morpholinyl]-3-(4-fluorophenyl)-1-oxo-2-propanyl}-2-methoxybenzamide [ACD/IUPAC Name]
3,6-Dichloro-N-{1-[2-(4-éthylphényl)-4-morpholinyl]-3-(4-fluorophényl)-1-oxo-2-propanyl}-2-méthoxybenzamide [French] [ACD/IUPAC Name]
Benzamide, 3,6-dichloro-N-[2-[2-(4-ethylphenyl)-4-morpholinyl]-1-[(4-fluorophenyl)methyl]-2-oxoethyl]-2-methoxy- [ACD/Index 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: 699.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.4±3.0 kJ/mol
Flash Point: 376.6±31.5 °C
Index of Refraction: 1.590
Molar Refractivity: 145.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.63
ACD/LogD (pH 5.5): 6.13
ACD/BCF (pH 5.5): 26638.25
ACD/KOC (pH 5.5): 51210.86
ACD/LogD (pH 7.4): 6.13
ACD/BCF (pH 7.4): 26637.60
ACD/KOC (pH 7.4): 51209.62
Polar Surface Area: 68 Å2
Polarizability: 57.7±0.5 10-24cm3
Surface Tension: 49.2±3.0 dyne/cm
Molar Volume: 431.2±3.0 cm3

Click to predict properties on the Chemicalize site


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