ChemSpider 2D Image | N-{[1-(3-Bromophenyl)-3-pyrrolidinyl]methyl}-1-(2-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide | C23H25BrFN3O2

N-{[1-(3-Bromophenyl)-3-pyrrolidinyl]methyl}-1-(2-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide

  • Molecular FormulaC23H25BrFN3O2
  • Average mass474.366 Da
  • Monoisotopic mass473.111420 Da
  • ChemSpider ID78295698

More details:

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

3-Pyrrolidinecarboxamide, N-[[1-(3-bromophenyl)-3-pyrrolidinyl]methyl]-1-(2-fluoro-4-methylphenyl)-5-oxo- [ACD/Index Name]
N-{[1-(3-Bromophenyl)-3-pyrrolidinyl]methyl}-1-(2-fluoro-4-methylphenyl)-5-oxo-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
N-{[1-(3-Bromophényl)-3-pyrrolidinyl]méthyl}-1-(2-fluoro-4-méthylphényl)-5-oxo-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
N-{[1-(3-Bromphenyl)-3-pyrrolidinyl]methyl}-1-(2-fluor-4-methylphenyl)-5-oxo-3-pyrrolidincarboxamid [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: 727.2±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.4 mmHg at 25°C
Enthalpy of Vaporization: 106.2±3.0 kJ/mol
Flash Point: 393.6±32.9 °C
Index of Refraction: 1.607
Molar Refractivity: 116.4±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.53
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 376.70
ACD/KOC (pH 5.5): 2421.51
ACD/LogD (pH 7.4): 3.70
ACD/BCF (pH 7.4): 380.98
ACD/KOC (pH 7.4): 2449.06
Polar Surface Area: 53 Å2
Polarizability: 46.1±0.5 10-24cm3
Surface Tension: 51.5±3.0 dyne/cm
Molar Volume: 337.2±3.0 cm3

Click to predict properties on the Chemicalize site


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