ChemSpider 2D Image | 3-[4-(4-Fluorophenyl)-1,3-thiazol-2-yl]-N-{2-[4-(4-methylbenzyl)-1-piperazinyl]-2-oxo-1-phenylethyl}propanamide | C32H33FN4O2S

3-[4-(4-Fluorophenyl)-1,3-thiazol-2-yl]-N-{2-[4-(4-methylbenzyl)-1-piperazinyl]-2-oxo-1-phenylethyl}propanamide

  • Molecular FormulaC32H33FN4O2S
  • Average mass556.693 Da
  • Monoisotopic mass556.230835 Da
  • ChemSpider ID121737889

More details:

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

2-Thiazolepropanamide, 4-(4-fluorophenyl)-N-[2-[4-[(4-methylphenyl)methyl]-1-piperazinyl]-2-oxo-1-phenylethyl]- [ACD/Index Name]
3-[4-(4-Fluorophenyl)-1,3-thiazol-2-yl]-N-{2-[4-(4-methylbenzyl)-1-piperazinyl]-2-oxo-1-phenylethyl}propanamide [ACD/IUPAC Name]
3-[4-(4-Fluorophényl)-1,3-thiazol-2-yl]-N-{2-[4-(4-méthylbenzyl)-1-pipérazinyl]-2-oxo-1-phényléthyl}propanamide [French] [ACD/IUPAC Name]
3-[4-(4-Fluorphenyl)-1,3-thiazol-2-yl]-N-{2-[4-(4-methylbenzyl)-1-piperazinyl]-2-oxo-1-phenylethyl}propanamid [German] [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: 771.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 112.3±3.0 kJ/mol
Flash Point: 420.3±32.9 °C
Index of Refraction: 1.621
Molar Refractivity: 156.3±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.69
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 870.87
ACD/KOC (pH 5.5): 3376.91
ACD/LogD (pH 7.4): 4.71
ACD/BCF (pH 7.4): 2211.89
ACD/KOC (pH 7.4): 8576.88
Polar Surface Area: 94 Å2
Polarizability: 62.0±0.5 10-24cm3
Surface Tension: 55.0±3.0 dyne/cm
Molar Volume: 444.2±3.0 cm3

Click to predict properties on the Chemicalize site


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