ChemSpider 2D Image | 2-Amino-1-[4-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide | C25H18F3N7O2

2-Amino-1-[4-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide

  • Molecular FormulaC25H18F3N7O2
  • Average mass505.451 Da
  • Monoisotopic mass505.147400 Da
  • ChemSpider ID35034249

More details:






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

1H-Pyrrolo[2,3-b]quinoxaline-3-carboxamide, 2-amino-1-[4-[[[[3-(trifluoromethyl)phenyl]amino]carbonyl]amino]phenyl]- [ACD/Index Name]
2-Amino-1-[4-({[3-(trifluormethyl)phenyl]carbamoyl}amino)phenyl]-1H-pyrrolo[2,3-b]chinoxalin-3-carboxamid [German] [ACD/IUPAC Name]
2-Amino-1-[4-({[3-(trifluoromethyl)phenyl]carbamoyl}amino)phenyl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide [ACD/IUPAC Name]
2-Amino-1-[4-({[3-(trifluorométhyl)phényl]carbamoyl}amino)phényl]-1H-pyrrolo[2,3-b]quinoxaline-3-carboxamide [French] [ACD/IUPAC Name]
Q7M

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

Density: 1.6±0.1 g/cm3
Boiling Point: 568.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 85.3±3.0 kJ/mol
Flash Point: 297.8±30.1 °C
Index of Refraction: 1.713
Molar Refractivity: 126.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 6
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 2
ACD/LogP: 3.76
ACD/LogD (pH 5.5): 3.69
ACD/BCF (pH 5.5): 377.22
ACD/KOC (pH 5.5): 2428.94
ACD/LogD (pH 7.4): 3.69
ACD/BCF (pH 7.4): 377.94
ACD/KOC (pH 7.4): 2433.55
Polar Surface Area: 141 Å2
Polarizability: 50.3±0.5 10-24cm3
Surface Tension: 59.7±7.0 dyne/cm
Molar Volume: 323.7±7.0 cm3

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