ChemSpider 2D Image | 1-(4-Bromobenzoyl)-N-{[1-(4-fluorophenyl)-3-pyrrolidinyl]methyl}prolinamide | C23H25BrFN3O2

1-(4-Bromobenzoyl)-N-{[1-(4-fluorophenyl)-3-pyrrolidinyl]methyl}prolinamide

  • Molecular FormulaC23H25BrFN3O2
  • Average mass474.366 Da
  • Monoisotopic mass473.111420 Da
  • ChemSpider ID70862075

More details:

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

1-(4-Brombenzoyl)-N-{[1-(4-fluorphenyl)-3-pyrrolidinyl]methyl}prolinamid [German] [ACD/IUPAC Name]
1-(4-Bromobenzoyl)-N-{[1-(4-fluorophenyl)-3-pyrrolidinyl]methyl}prolinamide [ACD/IUPAC Name]
1-(4-Bromobenzoyl)-N-{[1-(4-fluorophényl)-3-pyrrolidinyl]méthyl}prolinamide [French] [ACD/IUPAC Name]
2-Pyrrolidinecarboxamide, 1-(4-bromobenzoyl)-N-[[1-(4-fluorophenyl)-3-pyrrolidinyl]methyl]- [ACD/Index 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: 680.0±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 365.0±31.5 °C
Index of Refraction: 1.608
Molar Refractivity: 116.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.12
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 141.38
ACD/KOC (pH 5.5): 1145.01
ACD/LogD (pH 7.4): 3.23
ACD/BCF (pH 7.4): 168.60
ACD/KOC (pH 7.4): 1365.51
Polar Surface Area: 53 Å2
Polarizability: 46.2±0.5 10-24cm3
Surface Tension: 51.8±3.0 dyne/cm
Molar Volume: 337.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement