ChemSpider 2D Image | 2-Bromo-4-fluoro-N-{[6-(1-pyrrolidinyl)-3-pyridinyl]methyl}benzamide | C17H17BrFN3O

2-Bromo-4-fluoro-N-{[6-(1-pyrrolidinyl)-3-pyridinyl]methyl}benzamide

  • Molecular FormulaC17H17BrFN3O
  • Average mass378.239 Da
  • Monoisotopic mass377.053894 Da
  • ChemSpider ID22398354

More details:

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

2-Brom-4-fluor-N-{[6-(1-pyrrolidinyl)-3-pyridinyl]methyl}benzamid [German] [ACD/IUPAC Name]
2-Bromo-4-fluoro-N-{[6-(1-pyrrolidinyl)-3-pyridinyl]methyl}benzamide [ACD/IUPAC Name]
2-Bromo-4-fluoro-N-{[6-(1-pyrrolidinyl)-3-pyridinyl]méthyl}benzamide [French] [ACD/IUPAC Name]
Benzamide, 2-bromo-4-fluoro-N-[[6-(1-pyrrolidinyl)-3-pyridinyl]methyl]- [ACD/Index Name]
2-BROMO-4-FLUORO-N-{[6-(PYRROLIDIN-1-YL)PYRIDIN-3-YL]METHYL}BENZAMIDE

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

Density: 1.5±0.1 g/cm3
Boiling Point: 542.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.4 mmHg at 25°C
Enthalpy of Vaporization: 82.1±3.0 kJ/mol
Flash Point: 282.0±30.1 °C
Index of Refraction: 1.616
Molar Refractivity: 90.3±0.3 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 2.76
ACD/BCF (pH 5.5): 51.05
ACD/KOC (pH 5.5): 375.57
ACD/LogD (pH 7.4): 3.41
ACD/BCF (pH 7.4): 226.53
ACD/KOC (pH 7.4): 1666.52
Polar Surface Area: 45 Å2
Polarizability: 35.8±0.5 10-24cm3
Surface Tension: 53.8±3.0 dyne/cm
Molar Volume: 258.6±3.0 cm3

Click to predict properties on the Chemicalize site


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