ChemSpider 2D Image | 6-Chloro-3-(difluoromethyl)-1-{[4-methoxy-3-(1-piperazinyl)phenyl]sulfonyl}-1H-indole | C20H20ClF2N3O3S

6-Chloro-3-(difluoromethyl)-1-{[4-methoxy-3-(1-piperazinyl)phenyl]sulfonyl}-1H-indole

  • Molecular FormulaC20H20ClF2N3O3S
  • Average mass455.906 Da
  • Monoisotopic mass455.088196 Da
  • ChemSpider ID128978001

More details:

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

1H-Indole, 6-chloro-3-(difluoromethyl)-1-[[4-methoxy-3-(1-piperazinyl)phenyl]sulfonyl]- [ACD/Index Name]
6-Chlor-3-(difluormethyl)-1-{[4-methoxy-3-(1-piperazinyl)phenyl]sulfonyl}-1H-indol [German] [ACD/IUPAC Name]
6-Chloro-3-(difluoromethyl)-1-{[4-methoxy-3-(1-piperazinyl)phenyl]sulfonyl}-1H-indole [ACD/IUPAC Name]
6-Chloro-3-(difluorométhyl)-1-{[4-méthoxy-3-(1-pipérazinyl)phényl]sulfonyl}-1H-indole [French] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 657.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.8±3.0 kJ/mol
Flash Point: 351.6±34.3 °C
Index of Refraction: 1.640
Molar Refractivity: 110.8±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 4.19
ACD/LogD (pH 5.5): 1.02
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.69
ACD/LogD (pH 7.4): 2.63
ACD/BCF (pH 7.4): 30.76
ACD/KOC (pH 7.4): 189.97
Polar Surface Area: 72 Å2
Polarizability: 43.9±0.5 10-24cm3
Surface Tension: 49.8±7.0 dyne/cm
Molar Volume: 307.6±7.0 cm3

Click to predict properties on the Chemicalize site


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