ChemSpider 2D Image | 2-({2-[(4-Fluorophenyl)amino]-2-oxoethyl}sulfanyl)-N-[4-(4-morpholinyl)-2-(trifluoromethyl)benzyl]propanamide | C23H25F4N3O3S

2-({2-[(4-Fluorophenyl)amino]-2-oxoethyl}sulfanyl)-N-[4-(4-morpholinyl)-2-(trifluoromethyl)benzyl]propanamide

  • Molecular FormulaC23H25F4N3O3S
  • Average mass499.522 Da
  • Monoisotopic mass499.155273 Da
  • ChemSpider ID33440786

More details:

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

2-({2-[(4-Fluorophenyl)amino]-2-oxoethyl}sulfanyl)-N-[4-(4-morpholinyl)-2-(trifluoromethyl)benzyl]propanamide [ACD/IUPAC Name]
2-({2-[(4-Fluorophényl)amino]-2-oxoéthyl}sulfanyl)-N-[4-(4-morpholinyl)-2-(trifluorométhyl)benzyl]propanamide [French] [ACD/IUPAC Name]
2-({2-[(4-Fluorphenyl)amino]-2-oxoethyl}sulfanyl)-N-[4-(4-morpholinyl)-2-(trifluormethyl)benzyl]propanamid [German] [ACD/IUPAC Name]
Propanamide, 2-[[2-[(4-fluorophenyl)amino]-2-oxoethyl]thio]-N-[[4-(4-morpholinyl)-2-(trifluoromethyl)phenyl]methyl]- [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: 701.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.6±3.0 kJ/mol
Flash Point: 377.9±32.9 °C
Index of Refraction: 1.572
Molar Refractivity: 121.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 4.04
ACD/LogD (pH 5.5): 3.74
ACD/BCF (pH 5.5): 407.72
ACD/KOC (pH 5.5): 2563.47
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 411.87
ACD/KOC (pH 7.4): 2589.61
Polar Surface Area: 96 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 48.9±3.0 dyne/cm
Molar Volume: 370.6±3.0 cm3

Click to predict properties on the Chemicalize site


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