ChemSpider 2D Image | 2-(3-Bromo-2-methyl-1H-indol-1-yl)-N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]acetamide | C21H20BrClN4O2

2-(3-Bromo-2-methyl-1H-indol-1-yl)-N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]acetamide

  • Molecular FormulaC21H20BrClN4O2
  • Average mass475.766 Da
  • Monoisotopic mass474.045807 Da
  • ChemSpider ID31610757

More details:

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

1H-Indole-1-acetamide, 3-bromo-N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]-2-methyl- [ACD/Index Name]
2-(3-Brom-2-methyl-1H-indol-1-yl)-N-[3-chlor-4-(3-oxo-1-piperazinyl)phenyl]acetamid [German] [ACD/IUPAC Name]
2-(3-Bromo-2-methyl-1H-indol-1-yl)-N-[3-chloro-4-(3-oxo-1-piperazinyl)phenyl]acetamide [ACD/IUPAC Name]
2-(3-Bromo-2-méthyl-1H-indol-1-yl)-N-[3-chloro-4-(3-oxo-1-pipérazinyl)phényl]acétamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 768.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.9±3.0 kJ/mol
Flash Point: 418.5±32.9 °C
Index of Refraction: 1.698
Molar Refractivity: 116.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 2.82
ACD/LogD (pH 5.5): 3.74
ACD/BCF (pH 5.5): 411.63
ACD/KOC (pH 5.5): 2585.76
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 413.21
ACD/KOC (pH 7.4): 2595.68
Polar Surface Area: 66 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 56.3±7.0 dyne/cm
Molar Volume: 303.0±7.0 cm3

Click to predict properties on the Chemicalize site


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