ChemSpider 2D Image | 2-Bromo-N-[3-({1-[2-(dimethylamino)ethyl]-1H-indol-5-yl}amino)-3-oxopropyl]-5-fluorobenzamide | C22H24BrFN4O2

2-Bromo-N-[3-({1-[2-(dimethylamino)ethyl]-1H-indol-5-yl}amino)-3-oxopropyl]-5-fluorobenzamide

  • Molecular FormulaC22H24BrFN4O2
  • Average mass475.354 Da
  • Monoisotopic mass474.106659 Da
  • ChemSpider ID34352654

More details:






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

2-Brom-N-[3-({1-[2-(dimethylamino)ethyl]-1H-indol-5-yl}amino)-3-oxopropyl]-5-fluorbenzamid [German] [ACD/IUPAC Name]
2-Bromo-N-[3-({1-[2-(dimethylamino)ethyl]-1H-indol-5-yl}amino)-3-oxopropyl]-5-fluorobenzamide [ACD/IUPAC Name]
2-Bromo-N-[3-({1-[2-(diméthylamino)éthyl]-1H-indol-5-yl}amino)-3-oxopropyl]-5-fluorobenzamide [French] [ACD/IUPAC Name]
Benzamide, 2-bromo-N-[3-[[1-[2-(dimethylamino)ethyl]-1H-indol-5-yl]amino]-3-oxopropyl]-5-fluoro- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point: 653.5±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.3±3.0 kJ/mol
Flash Point: 349.0±31.5 °C
Index of Refraction: 1.617
Molar Refractivity: 119.1±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.94
ACD/LogD (pH 5.5): 0.28
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.40
ACD/LogD (pH 7.4): 1.35
ACD/BCF (pH 7.4): 2.12
ACD/KOC (pH 7.4): 16.49
Polar Surface Area: 66 Å2
Polarizability: 47.2±0.5 10-24cm3
Surface Tension: 46.2±7.0 dyne/cm
Molar Volume: 340.3±7.0 cm3

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