ChemSpider 2D Image | 3-[(2-Chloro-4-fluorophenyl)amino]-1-[2-(1-methyl-1H-indol-3-yl)ethyl]-4-(2-nitrophenyl)-1H-pyrrole-2,5-dione | C27H20ClFN4O4

3-[(2-Chloro-4-fluorophenyl)amino]-1-[2-(1-methyl-1H-indol-3-yl)ethyl]-4-(2-nitrophenyl)-1H-pyrrole-2,5-dione

  • Molecular FormulaC27H20ClFN4O4
  • Average mass518.924 Da
  • Monoisotopic mass518.115723 Da
  • ChemSpider ID118988006

More details:

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

1H-Pyrrole-2,5-dione, 3-[(2-chloro-4-fluorophenyl)amino]-1-[2-(1-methyl-1H-indol-3-yl)ethyl]-4-(2-nitrophenyl)- [ACD/Index Name]
3-[(2-Chlor-4-fluorphenyl)amino]-1-[2-(1-methyl-1H-indol-3-yl)ethyl]-4-(2-nitrophenyl)-1H-pyrrol-2,5-dion [German] [ACD/IUPAC Name]
3-[(2-Chloro-4-fluorophenyl)amino]-1-[2-(1-methyl-1H-indol-3-yl)ethyl]-4-(2-nitrophenyl)-1H-pyrrole-2,5-dione [ACD/IUPAC Name]
3-[(2-Chloro-4-fluorophényl)amino]-1-[2-(1-méthyl-1H-indol-3-yl)éthyl]-4-(2-nitrophényl)-1H-pyrrole-2,5-dione [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: 705.5±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 103.2±3.0 kJ/mol
Flash Point: 380.5±32.9 °C
Index of Refraction: 1.681
Molar Refractivity: 136.9±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 5.17
ACD/LogD (pH 5.5): 4.86
ACD/BCF (pH 5.5): 2884.39
ACD/KOC (pH 5.5): 10430.42
ACD/LogD (pH 7.4): 4.86
ACD/BCF (pH 7.4): 2884.39
ACD/KOC (pH 7.4): 10430.42
Polar Surface Area: 100 Å2
Polarizability: 54.3±0.5 10-24cm3
Surface Tension: 56.0±7.0 dyne/cm
Molar Volume: 361.6±7.0 cm3

Click to predict properties on the Chemicalize site


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