ChemSpider 2D Image | 4-Phenyl-N-{2-[4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinyl]ethyl}tetrahydro-2H-pyran-4-carboxamide | C23H26F3N3O2

4-Phenyl-N-{2-[4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinyl]ethyl}tetrahydro-2H-pyran-4-carboxamide

  • Molecular FormulaC23H26F3N3O2
  • Average mass433.467 Da
  • Monoisotopic mass433.197723 Da
  • ChemSpider ID30675324

More details:

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

2H-Pyran-4-carboxamide, tetrahydro-4-phenyl-N-[2-[5,6,7,8-tetrahydro-4-(trifluoromethyl)-2-quinazolinyl]ethyl]- [ACD/Index Name]
4-Phenyl-N-{2-[4-(trifluormethyl)-5,6,7,8-tetrahydro-2-chinazolinyl]ethyl}tetrahydro-2H-pyran-4-carboxamid [German] [ACD/IUPAC Name]
4-Phenyl-N-{2-[4-(trifluoromethyl)-5,6,7,8-tetrahydro-2-quinazolinyl]ethyl}tetrahydro-2H-pyran-4-carboxamide [ACD/IUPAC Name]
4-Phényl-N-{2-[4-(trifluorométhyl)-5,6,7,8-tétrahydro-2-quinazolinyl]éthyl}tétrahydro-2H-pyrane-4-carboxamide [French] [ACD/IUPAC Name]
1396812-47-7 [RN]
4-phenyl-N-(2-(4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-yl)ethyl)tetrahydro-2H-pyran-4-carboxamide
4-phenyl-N-{2-[4-(trifluoromethyl)-5,6,7,8-tetrahydroquinazolin-2-yl]ethyl}oxane-4-carboxamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.3±0.1 g/cm3
Boiling Point: 580.2±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.8±3.0 kJ/mol
Flash Point: 304.7±30.1 °C
Index of Refraction: 1.545
Molar Refractivity: 108.9±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.62
ACD/LogD (pH 5.5): 3.84
ACD/BCF (pH 5.5): 485.50
ACD/KOC (pH 5.5): 2913.24
ACD/LogD (pH 7.4): 3.84
ACD/BCF (pH 7.4): 485.50
ACD/KOC (pH 7.4): 2913.26
Polar Surface Area: 64 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 46.5±3.0 dyne/cm
Molar Volume: 344.2±3.0 cm3

Click to predict properties on the Chemicalize site


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