ChemSpider 2D Image | 2-Bromo-N-(3-{[6-(dimethylamino)-2-pyridinyl]amino}-3-oxopropyl)-5-fluorobenzamide | C17H18BrFN4O2

2-Bromo-N-(3-{[6-(dimethylamino)-2-pyridinyl]amino}-3-oxopropyl)-5-fluorobenzamide

  • Molecular FormulaC17H18BrFN4O2
  • Average mass409.253 Da
  • Monoisotopic mass408.059723 Da
  • ChemSpider ID30427492

More details:

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

2-Brom-N-(3-{[6-(dimethylamino)-2-pyridinyl]amino}-3-oxopropyl)-5-fluorbenzamid [German] [ACD/IUPAC Name]
2-Bromo-N-(3-{[6-(dimethylamino)-2-pyridinyl]amino}-3-oxopropyl)-5-fluorobenzamide [ACD/IUPAC Name]
2-Bromo-N-(3-{[6-(diméthylamino)-2-pyridinyl]amino}-3-oxopropyl)-5-fluorobenzamide [French] [ACD/IUPAC Name]
Benzamide, 2-bromo-N-[3-[[6-(dimethylamino)-2-pyridinyl]amino]-3-oxopropyl]-5-fluoro- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 597.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 315.3±30.1 °C
Index of Refraction: 1.634
Molar Refractivity: 98.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.78
ACD/LogD (pH 5.5): 2.68
ACD/BCF (pH 5.5): 63.77
ACD/KOC (pH 5.5): 679.96
ACD/LogD (pH 7.4): 2.68
ACD/BCF (pH 7.4): 64.21
ACD/KOC (pH 7.4): 684.70
Polar Surface Area: 74 Å2
Polarizability: 39.0±0.5 10-24cm3
Surface Tension: 55.9±3.0 dyne/cm
Molar Volume: 275.4±3.0 cm3

Click to predict properties on the Chemicalize site


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