ChemSpider 2D Image | 4-{4-[3-(3-Methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-pyridinyl}-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide | C33H29F3N6O2

4-{4-[3-(3-Methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-pyridinyl}-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide

  • Molecular FormulaC33H29F3N6O2
  • Average mass598.618 Da
  • Monoisotopic mass598.230408 Da
  • ChemSpider ID129204267

More details:

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

1-Piperazinecarboxamide, 4-[4-[3-(3-methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-pyridinyl]-N-[3-(trifluoromethyl)phenyl]- [ACD/Index Name]
4-{4-[3-(3-Methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-pyridinyl}-N-[3-(trifluormethyl)phenyl]-1-piperazincarboxamid [German] [ACD/IUPAC Name]
4-{4-[3-(3-Methoxyphenyl)-1-phenyl-1H-pyrazol-4-yl]-2-pyridinyl}-N-[3-(trifluoromethyl)phenyl]-1-piperazinecarboxamide [ACD/IUPAC Name]
4-{4-[3-(3-Méthoxyphényl)-1-phényl-1H-pyrazol-4-yl]-2-pyridinyl}-N-[3-(trifluorométhyl)phényl]-1-pipérazinecarboxamide [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: 753.6±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 109.8±3.0 kJ/mol
Flash Point: 409.5±32.9 °C
Index of Refraction: 1.633
Molar Refractivity: 162.6±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 6.00
ACD/LogD (pH 5.5): 3.96
ACD/BCF (pH 5.5): 223.27
ACD/KOC (pH 5.5): 518.65
ACD/LogD (pH 7.4): 5.46
ACD/BCF (pH 7.4): 7069.82
ACD/KOC (pH 7.4): 16423.15
Polar Surface Area: 76 Å2
Polarizability: 64.4±0.5 10-24cm3
Surface Tension: 47.4±7.0 dyne/cm
Molar Volume: 455.1±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement