ChemSpider 2D Image | 1-({4-[4-(4-Fluorophenyl)-1-piperazinyl]-6-[(4-propoxyphenyl)amino]-1,3,5-triazin-2-yl}amino)-2-propanol | C25H32FN7O2

1-({4-[4-(4-Fluorophenyl)-1-piperazinyl]-6-[(4-propoxyphenyl)amino]-1,3,5-triazin-2-yl}amino)-2-propanol

  • Molecular FormulaC25H32FN7O2
  • Average mass481.566 Da
  • Monoisotopic mass481.260162 Da
  • ChemSpider ID124688486

More details:

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

1-({4-[4-(4-Fluorophenyl)-1-piperazinyl]-6-[(4-propoxyphenyl)amino]-1,3,5-triazin-2-yl}amino)-2-propanol [ACD/IUPAC Name]
1-({4-[4-(4-Fluorophényl)-1-pipérazinyl]-6-[(4-propoxyphényl)amino]-1,3,5-triazin-2-yl}amino)-2-propanol [French] [ACD/IUPAC Name]
1-({4-[4-(4-Fluorphenyl)-1-piperazinyl]-6-[(4-propoxyphenyl)amino]-1,3,5-triazin-2-yl}amino)-2-propanol [German] [ACD/IUPAC Name]
2-Propanol, 1-[[4-[4-(4-fluorophenyl)-1-piperazinyl]-6-[(4-propoxyphenyl)amino]-1,3,5-triazin-2-yl]amino]- [ACD/Index 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: 697.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 107.3±3.0 kJ/mol
Flash Point: 375.7±34.3 °C
Index of Refraction: 1.638
Molar Refractivity: 134.4±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 1.94
ACD/LogD (pH 5.5): 1.81
ACD/BCF (pH 5.5): 7.18
ACD/KOC (pH 5.5): 64.81
ACD/LogD (pH 7.4): 2.94
ACD/BCF (pH 7.4): 97.04
ACD/KOC (pH 7.4): 875.49
Polar Surface Area: 99 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 63.3±3.0 dyne/cm
Molar Volume: 374.2±3.0 cm3

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