ChemSpider 2D Image | [4-(3,4-Difluorobenzoyl)-1-piperazinyl](5-methoxy-1H-indol-2-yl)methanone | C21H19F2N3O3

[4-(3,4-Difluorobenzoyl)-1-piperazinyl](5-methoxy-1H-indol-2-yl)methanone

  • Molecular FormulaC21H19F2N3O3
  • Average mass399.391 Da
  • Monoisotopic mass399.139435 Da
  • ChemSpider ID29188482

More details:

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

[4-(3,4-Difluorbenzoyl)-1-piperazinyl](5-methoxy-1H-indol-2-yl)methanon [German] [ACD/IUPAC Name]
[4-(3,4-Difluorobenzoyl)-1-piperazinyl](5-methoxy-1H-indol-2-yl)methanone [ACD/IUPAC Name]
[4-(3,4-Difluorobenzoyl)-1-pipérazinyl](5-méthoxy-1H-indol-2-yl)méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(3,4-difluorobenzoyl)-1-piperazinyl](5-methoxy-1H-indol-2-yl)- [ACD/Index Name]
6-fluoro-2-(pyrrolidin-1-ylcarbonyl)-4-(3,4,5-trimethoxyphenyl)-4H-1,4-benzothiazine 1,1-dioxide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 646.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.3±3.0 kJ/mol
Flash Point: 344.6±31.5 °C
Index of Refraction: 1.642
Molar Refractivity: 103.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 0.29
ACD/LogD (pH 5.5): 1.67
ACD/BCF (pH 5.5): 10.89
ACD/KOC (pH 5.5): 192.25
ACD/LogD (pH 7.4): 1.67
ACD/BCF (pH 7.4): 10.89
ACD/KOC (pH 7.4): 192.25
Polar Surface Area: 66 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 57.3±3.0 dyne/cm
Molar Volume: 287.5±3.0 cm3

Click to predict properties on the Chemicalize site


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