ChemSpider 2D Image | 5-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-2-furamide | C22H26BrFN4O2

5-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-2-furamide

  • Molecular FormulaC22H26BrFN4O2
  • Average mass477.370 Da
  • Monoisotopic mass476.122314 Da
  • ChemSpider ID76854276

More details:

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

2-Furancarboxamide, 5-[(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]- [ACD/Index Name]
5-[(4-Brom-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[3-(dimethylamino)-1-(4-fluorphenyl)propyl]-2-furamid [German] [ACD/IUPAC Name]
5-[(4-Bromo-3,5-dimethyl-1H-pyrazol-1-yl)methyl]-N-[3-(dimethylamino)-1-(4-fluorophenyl)propyl]-2-furamide [ACD/IUPAC Name]
5-[(4-Bromo-3,5-diméthyl-1H-pyrazol-1-yl)méthyl]-N-[3-(diméthylamino)-1-(4-fluorophényl)propyl]-2-furamide [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: 604.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 319.6±31.5 °C
Index of Refraction: 1.602
Molar Refractivity: 119.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.91
ACD/LogD (pH 5.5): 0.75
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.66
ACD/LogD (pH 7.4): 2.03
ACD/BCF (pH 7.4): 7.97
ACD/KOC (pH 7.4): 50.30
Polar Surface Area: 63 Å2
Polarizability: 47.3±0.5 10-24cm3
Surface Tension: 42.1±7.0 dyne/cm
Molar Volume: 347.7±7.0 cm3

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