ChemSpider 2D Image | 2-({4-[Benzyl(methyl)amino]-6-[(3-chloro-4-fluorophenyl)amino]-1,3,5-triazin-2-yl}amino)-1-(4-chlorophenyl)ethanol | C25H23Cl2FN6O

2-({4-[Benzyl(methyl)amino]-6-[(3-chloro-4-fluorophenyl)amino]-1,3,5-triazin-2-yl}amino)-1-(4-chlorophenyl)ethanol

  • Molecular FormulaC25H23Cl2FN6O
  • Average mass513.394 Da
  • Monoisotopic mass512.129456 Da
  • ChemSpider ID124641724

More details:

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

2-({4-[Benzyl(methyl)amino]-6-[(3-chlor-4-fluorphenyl)amino]-1,3,5-triazin-2-yl}amino)-1-(4-chlorphenyl)ethanol [German] [ACD/IUPAC Name]
2-({4-[Benzyl(methyl)amino]-6-[(3-chloro-4-fluorophenyl)amino]-1,3,5-triazin-2-yl}amino)-1-(4-chlorophenyl)ethanol [ACD/IUPAC Name]
2-({4-[Benzyl(méthyl)amino]-6-[(3-chloro-4-fluorophényl)amino]-1,3,5-triazin-2-yl}amino)-1-(4-chlorophényl)éthanol [French] [ACD/IUPAC Name]
Benzenemethanol, 4-chloro-α-[[[4-[(3-chloro-4-fluorophenyl)amino]-6-[methyl(phenylmethyl)amino]-1,3,5-triazin-2-yl]amino]methyl]- [ACD/Index 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: 710.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 109.0±3.0 kJ/mol
Flash Point: 383.3±35.7 °C
Index of Refraction: 1.705
Molar Refractivity: 138.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 5.16
ACD/BCF (pH 5.5): 4790.87
ACD/KOC (pH 5.5): 14571.42
ACD/LogD (pH 7.4): 5.20
ACD/BCF (pH 7.4): 5295.69
ACD/KOC (pH 7.4): 16106.82
Polar Surface Area: 86 Å2
Polarizability: 55.0±0.5 10-24cm3
Surface Tension: 67.3±3.0 dyne/cm
Molar Volume: 356.9±3.0 cm3

Click to predict properties on the Chemicalize site


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