ChemSpider 2D Image | N-(3-{[1-(1H-Benzimidazol-2-yl)-3-methylbutyl]amino}-3-oxopropyl)-2-bromo-5-fluorobenzamide | C22H24BrFN4O2

N-(3-{[1-(1H-Benzimidazol-2-yl)-3-methylbutyl]amino}-3-oxopropyl)-2-bromo-5-fluorobenzamide

  • Molecular FormulaC22H24BrFN4O2
  • Average mass475.354 Da
  • Monoisotopic mass474.106659 Da
  • ChemSpider ID48166318

More details:






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

Benzamide, N-[3-[[1-(1H-benzimidazol-2-yl)-3-methylbutyl]amino]-3-oxopropyl]-2-bromo-5-fluoro- [ACD/Index Name]
N-(3-{[1-(1H-Benzimidazol-2-yl)-3-methylbutyl]amino}-3-oxopropyl)-2-brom-5-fluorbenzamid [German] [ACD/IUPAC Name]
N-(3-{[1-(1H-Benzimidazol-2-yl)-3-methylbutyl]amino}-3-oxopropyl)-2-bromo-5-fluorobenzamide [ACD/IUPAC Name]
N-(3-{[1-(1H-Benzimidazol-2-yl)-3-méthylbutyl]amino}-3-oxopropyl)-2-bromo-5-fluorobenzamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 690.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.1±3.0 kJ/mol
Flash Point: 371.1±31.5 °C
Index of Refraction: 1.615
Molar Refractivity: 118.4±0.3 cm3
#H bond acceptors: 6
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 3.17
ACD/BCF (pH 5.5): 136.97
ACD/KOC (pH 5.5): 1041.72
ACD/LogD (pH 7.4): 3.36
ACD/BCF (pH 7.4): 209.42
ACD/KOC (pH 7.4): 1592.67
Polar Surface Area: 87 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 53.1±3.0 dyne/cm
Molar Volume: 339.1±3.0 cm3

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