ChemSpider 2D Image | N-[2-Fluoro-5-({8-[2-(4-morpholinyl)ethoxy]-11-oxo-6,11-dihydrodibenzo[b,e]oxepin-3-yl}amino)phenyl]benzamide | C33H30FN3O5

N-[2-Fluoro-5-({8-[2-(4-morpholinyl)ethoxy]-11-oxo-6,11-dihydrodibenzo[b,e]oxepin-3-yl}amino)phenyl]benzamide

  • Molecular FormulaC33H30FN3O5
  • Average mass567.607 Da
  • Monoisotopic mass567.216919 Da
  • ChemSpider ID31148212

More details:

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

Benzamide, N-[5-[[6,11-dihydro-8-[2-(4-morpholinyl)ethoxy]-11-oxodibenz[b,e]oxepin-3-yl]amino]-2-fluorophenyl]- [ACD/Index Name]
N-[2-Fluor-5-({8-[2-(4-morpholinyl)ethoxy]-11-oxo-6,11-dihydrodibenzo[b,e]oxepin-3-yl}amino)phenyl]benzamid [German] [ACD/IUPAC Name]
N-[2-Fluoro-5-({8-[2-(4-morpholinyl)ethoxy]-11-oxo-6,11-dihydrodibenzo[b,e]oxepin-3-yl}amino)phenyl]benzamide [ACD/IUPAC Name]
N-[2-Fluoro-5-({8-[2-(4-morpholinyl)éthoxy]-11-oxo-6,11-dihydrodibenzo[b,e]oxépin-3-yl}amino)phényl]benzamide [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: 705.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.2±3.0 kJ/mol
Flash Point: 380.5±32.9 °C
Index of Refraction: 1.660
Molar Refractivity: 157.0±0.3 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 3.49
ACD/BCF (pH 5.5): 158.93
ACD/KOC (pH 5.5): 709.97
ACD/LogD (pH 7.4): 4.39
ACD/BCF (pH 7.4): 1250.31
ACD/KOC (pH 7.4): 5585.50
Polar Surface Area: 89 Å2
Polarizability: 62.3±0.5 10-24cm3
Surface Tension: 59.0±3.0 dyne/cm
Molar Volume: 425.6±3.0 cm3

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