ChemSpider 2D Image | N-{4-[3-(4-Chlorophenoxy)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide | C28H24ClN3O6

N-{4-[3-(4-Chlorophenoxy)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide

  • Molecular FormulaC28H24ClN3O6
  • Average mass533.960 Da
  • Monoisotopic mass533.135376 Da
  • ChemSpider ID30859125

More details:

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

2H-Isoindole-2-acetamide, N-[4-[3-(4-chlorophenoxy)propyl]-3,4-dihydro-3-oxo-2H-1,4-benzoxazin-6-yl]-1,3-dihydro-α-methyl-1,3-dioxo- [ACD/Index Name]
N-{4-[3-(4-Chlorophenoxy)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide [ACD/IUPAC Name]
N-{4-[3-(4-Chlorophénoxy)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamide [French] [ACD/IUPAC Name]
N-{4-[3-(4-Chlorphenoxy)propyl]-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-6-yl}-2-(1,3-dioxo-1,3-dihydro-2H-isoindol-2-yl)propanamid [German] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 824.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.8±3.0 kJ/mol
Flash Point: 452.1±34.3 °C
Index of Refraction: 1.660
Molar Refractivity: 138.7±0.3 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.98
ACD/LogD (pH 5.5): 4.21
ACD/BCF (pH 5.5): 937.66
ACD/KOC (pH 5.5): 4666.42
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 937.70
ACD/KOC (pH 7.4): 4666.60
Polar Surface Area: 105 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 64.7±3.0 dyne/cm
Molar Volume: 375.5±3.0 cm3

Click to predict properties on the Chemicalize site


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