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

2-({2-[(4-Fluorophenyl)amino]-2-oxoethyl}sulfanyl)-N-{2-(4-morpholinyl)-2-[4-(trifluoromethyl)phenyl]ethyl}acetamide

  • Molecular FormulaC23H25F4N3O3S
  • Average mass499.522 Da
  • Monoisotopic mass499.155273 Da
  • ChemSpider ID70858859

More details:

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

2-({2-[(4-Fluorophenyl)amino]-2-oxoethyl}sulfanyl)-N-{2-(4-morpholinyl)-2-[4-(trifluoromethyl)phenyl]ethyl}acetamide [ACD/IUPAC Name]
2-({2-[(4-Fluorophényl)amino]-2-oxoéthyl}sulfanyl)-N-{2-(4-morpholinyl)-2-[4-(trifluorométhyl)phényl]éthyl}acétamide [French] [ACD/IUPAC Name]
2-({2-[(4-Fluorphenyl)amino]-2-oxoethyl}sulfanyl)-N-{2-(4-morpholinyl)-2-[4-(trifluormethyl)phenyl]ethyl}acetamid [German] [ACD/IUPAC Name]
Acetamide, 2-[[2-[(4-fluorophenyl)amino]-2-oxoethyl]thio]-N-[2-(4-morpholinyl)-2-[4-(trifluoromethyl)phenyl]ethyl]- [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: 674.6±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.1±3.0 kJ/mol
Flash Point: 361.8±31.5 °C
Index of Refraction: 1.574
Molar Refractivity: 121.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 0
ACD/LogP: 3.02
ACD/LogD (pH 5.5): 2.99
ACD/BCF (pH 5.5): 103.58
ACD/KOC (pH 5.5): 891.17
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 136.10
ACD/KOC (pH 7.4): 1170.93
Polar Surface Area: 96 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 368.7±3.0 cm3

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