ChemSpider 2D Image | 5-[(2-Chloro-6-fluorobenzyl)oxy]-2-{[(4-chlorophenyl)amino]methyl}-1-[2-(diethylamino)ethyl]-4(1H)-pyridinone | C25H28Cl2FN3O2

5-[(2-Chloro-6-fluorobenzyl)oxy]-2-{[(4-chlorophenyl)amino]methyl}-1-[2-(diethylamino)ethyl]-4(1H)-pyridinone

  • Molecular FormulaC25H28Cl2FN3O2
  • Average mass492.413 Da
  • Monoisotopic mass491.154266 Da
  • ChemSpider ID124130808

More details:

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

4(1H)-Pyridinone, 5-[(2-chloro-6-fluorophenyl)methoxy]-2-[[(4-chlorophenyl)amino]methyl]-1-[2-(diethylamino)ethyl]- [ACD/Index Name]
5-[(2-Chlor-6-fluorbenzyl)oxy]-2-{[(4-chlorphenyl)amino]methyl}-1-[2-(diethylamino)ethyl]-4(1H)-pyridinon [German] [ACD/IUPAC Name]
5-[(2-Chloro-6-fluorobenzyl)oxy]-2-{[(4-chlorophenyl)amino]methyl}-1-[2-(diethylamino)ethyl]-4(1H)-pyridinone [ACD/IUPAC Name]
5-[(2-Chloro-6-fluorobenzyl)oxy]-2-{[(4-chlorophényl)amino]méthyl}-1-[2-(diéthylamino)éthyl]-4(1H)-pyridinone [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: 635.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.9±3.0 kJ/mol
Flash Point: 338.0±31.5 °C
Index of Refraction: 1.614
Molar Refractivity: 132.0±0.4 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 1
ACD/LogP: 5.06
ACD/LogD (pH 5.5): 1.86
ACD/BCF (pH 5.5): 2.80
ACD/KOC (pH 5.5): 9.78
ACD/LogD (pH 7.4): 2.82
ACD/BCF (pH 7.4): 25.41
ACD/KOC (pH 7.4): 88.85
Polar Surface Area: 45 Å2
Polarizability: 52.3±0.5 10-24cm3
Surface Tension: 53.5±5.0 dyne/cm
Molar Volume: 378.9±5.0 cm3

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