ChemSpider 2D Image | N-[1-(2,4-Difluorobenzyl)-4-piperidinyl]-N-(4-fluorophenyl)tetrahydro-2-thiophenecarboxamide | C23H25F3N2OS

N-[1-(2,4-Difluorobenzyl)-4-piperidinyl]-N-(4-fluorophenyl)tetrahydro-2-thiophenecarboxamide

  • Molecular FormulaC23H25F3N2OS
  • Average mass434.518 Da
  • Monoisotopic mass434.163971 Da
  • ChemSpider ID109950109

More details:

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

2-Thiophenecarboxamide, N-[1-[(2,4-difluorophenyl)methyl]-4-piperidinyl]-N-(4-fluorophenyl)tetrahydro- [ACD/Index Name]
N-[1-(2,4-Difluorbenzyl)-4-piperidinyl]-N-(4-fluorphenyl)tetrahydro-2-thiophencarboxamid [German] [ACD/IUPAC Name]
N-[1-(2,4-Difluorobenzyl)-4-piperidinyl]-N-(4-fluorophenyl)tetrahydro-2-thiophenecarboxamide [ACD/IUPAC Name]
N-[1-(2,4-Difluorobenzyl)-4-pipéridinyl]-N-(4-fluorophényl)tétrahydro-2-thiophènecarboxamide [French] [ACD/IUPAC 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: 540.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.8±3.0 kJ/mol
Flash Point: 280.8±30.1 °C
Index of Refraction: 1.609
Molar Refractivity: 114.2±0.3 cm3
#H bond acceptors: 3
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.87
ACD/LogD (pH 5.5): 2.69
ACD/BCF (pH 5.5): 34.00
ACD/KOC (pH 5.5): 201.13
ACD/LogD (pH 7.4): 3.79
ACD/BCF (pH 7.4): 433.14
ACD/KOC (pH 7.4): 2562.39
Polar Surface Area: 49 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 52.4±3.0 dyne/cm
Molar Volume: 329.8±3.0 cm3

Click to predict properties on the Chemicalize site


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