ChemSpider 2D Image | 5-(4-Chlorophenyl)-N-[4-(4-methyl-1-piperazinyl)-2-(trifluoromethyl)phenyl]-2-thiophenecarboxamide | C23H21ClF3N3OS

5-(4-Chlorophenyl)-N-[4-(4-methyl-1-piperazinyl)-2-(trifluoromethyl)phenyl]-2-thiophenecarboxamide

  • Molecular FormulaC23H21ClF3N3OS
  • Average mass479.945 Da
  • Monoisotopic mass479.104584 Da
  • ChemSpider ID33620170

More details:

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

2-Thiophenecarboxamide, 5-(4-chlorophenyl)-N-[4-(4-methyl-1-piperazinyl)-2-(trifluoromethyl)phenyl]- [ACD/Index Name]
5-(4-Chlorophenyl)-N-[4-(4-methyl-1-piperazinyl)-2-(trifluoromethyl)phenyl]-2-thiophenecarboxamide [ACD/IUPAC Name]
5-(4-Chlorophényl)-N-[4-(4-méthyl-1-pipérazinyl)-2-(trifluorométhyl)phényl]-2-thiophènecarboxamide [French] [ACD/IUPAC Name]
5-(4-Chlorphenyl)-N-[4-(4-methyl-1-piperazinyl)-2-(trifluormethyl)phenyl]-2-thiophencarboxamid [German] [ACD/IUPAC 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: 535.6±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 81.2±3.0 kJ/mol
Flash Point: 277.7±30.1 °C
Index of Refraction: 1.611
Molar Refractivity: 122.2±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 6.20
ACD/LogD (pH 5.5): 3.29
ACD/BCF (pH 5.5): 65.21
ACD/KOC (pH 5.5): 199.11
ACD/LogD (pH 7.4): 4.88
ACD/BCF (pH 7.4): 2533.08
ACD/KOC (pH 7.4): 7735.19
Polar Surface Area: 64 Å2
Polarizability: 48.4±0.5 10-24cm3
Surface Tension: 48.5±3.0 dyne/cm
Molar Volume: 351.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement