ChemSpider 2D Image | 2-(3-Bromo-2-methyl-1H-indol-1-yl)-N-{[1-(4-fluorophenyl)-3-pyrrolidinyl]methyl}acetamide | C22H23BrFN3O

2-(3-Bromo-2-methyl-1H-indol-1-yl)-N-{[1-(4-fluorophenyl)-3-pyrrolidinyl]methyl}acetamide

  • Molecular FormulaC22H23BrFN3O
  • Average mass444.340 Da
  • Monoisotopic mass443.100861 Da
  • ChemSpider ID70369150

More details:

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

1H-Indole-1-acetamide, 3-bromo-N-[[1-(4-fluorophenyl)-3-pyrrolidinyl]methyl]-2-methyl- [ACD/Index Name]
2-(3-Brom-2-methyl-1H-indol-1-yl)-N-{[1-(4-fluorphenyl)-3-pyrrolidinyl]methyl}acetamid [German] [ACD/IUPAC Name]
2-(3-Bromo-2-methyl-1H-indol-1-yl)-N-{[1-(4-fluorophenyl)-3-pyrrolidinyl]methyl}acetamide [ACD/IUPAC Name]
2-(3-Bromo-2-méthyl-1H-indol-1-yl)-N-{[1-(4-fluorophényl)-3-pyrrolidinyl]méthyl}acétamide [French] [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: 646.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 344.8±31.5 °C
Index of Refraction: 1.646
Molar Refractivity: 112.8±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.43
ACD/LogD (pH 5.5): 4.49
ACD/BCF (pH 5.5): 1449.64
ACD/KOC (pH 5.5): 6053.74
ACD/LogD (pH 7.4): 4.57
ACD/BCF (pH 7.4): 1733.81
ACD/KOC (pH 7.4): 7240.44
Polar Surface Area: 37 Å2
Polarizability: 44.7±0.5 10-24cm3
Surface Tension: 47.2±7.0 dyne/cm
Molar Volume: 310.7±7.0 cm3

Click to predict properties on the Chemicalize site


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