ChemSpider 2D Image | N-[3-(1,3-Dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-N-(4-phenoxyphenyl)pentanamide | C32H30N2O4

N-[3-(1,3-Dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-N-(4-phenoxyphenyl)pentanamide

  • Molecular FormulaC32H30N2O4
  • Average mass506.592 Da
  • Monoisotopic mass506.220551 Da
  • ChemSpider ID2758306

More details:

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

N-[3-(1,3-Dioxo-1H-benzo[de]isochinolin-2(3H)-yl)propyl]-N-(4-phenoxyphenyl)pentanamid [German] [ACD/IUPAC Name]
N-[3-(1,3-Dioxo-1H-benzo[de]isoquinoléin-2(3H)-yl)propyl]-N-(4-phénoxyphényl)pentanamide [French] [ACD/IUPAC Name]
N-[3-(1,3-Dioxo-1H-benzo[de]isoquinolin-2(3H)-yl)propyl]-N-(4-phenoxyphenyl)pentanamide [ACD/IUPAC Name]
Pentanamide, N-[3-(1,3-dioxo-1H-benz[de]isoquinolin-2(3H)-yl)propyl]-N-(4-phenoxyphenyl)- [ACD/Index Name]

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

ZINC04256952 [DBID]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 686.1±40.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.6±3.0 kJ/mol
Flash Point: 368.7±27.3 °C
Index of Refraction: 1.650
Molar Refractivity: 148.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.13
ACD/LogD (pH 5.5): 5.11
ACD/BCF (pH 5.5): 4490.58
ACD/KOC (pH 5.5): 14318.90
ACD/LogD (pH 7.4): 5.11
ACD/BCF (pH 7.4): 4490.65
ACD/KOC (pH 7.4): 14319.10
Polar Surface Area: 67 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 55.9±3.0 dyne/cm
Molar Volume: 406.9±3.0 cm3

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