ChemSpider 2D Image | 3,4-Difluoro-N-(3-{4-[(4-methyl-1-piperazinyl)carbonyl]-1-piperidinyl}-3-oxopropyl)benzenesulfonamide | C20H28F2N4O4S

3,4-Difluoro-N-(3-{4-[(4-methyl-1-piperazinyl)carbonyl]-1-piperidinyl}-3-oxopropyl)benzenesulfonamide

  • Molecular FormulaC20H28F2N4O4S
  • Average mass458.522 Da
  • Monoisotopic mass458.179932 Da
  • ChemSpider ID34394066

More details:

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

3,4-Difluor-N-(3-{4-[(4-methyl-1-piperazinyl)carbonyl]-1-piperidinyl}-3-oxopropyl)benzolsulfonamid [German] [ACD/IUPAC Name]
3,4-Difluoro-N-(3-{4-[(4-methyl-1-piperazinyl)carbonyl]-1-piperidinyl}-3-oxopropyl)benzenesulfonamide [ACD/IUPAC Name]
3,4-Difluoro-N-(3-{4-[(4-méthyl-1-pipérazinyl)carbonyl]-1-pipéridinyl}-3-oxopropyl)benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 3,4-difluoro-N-[3-[4-[(4-methyl-1-piperazinyl)carbonyl]-1-piperidinyl]-3-oxopropyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 649.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.7±3.0 kJ/mol
Flash Point: 346.4±34.3 °C
Index of Refraction: 1.564
Molar Refractivity: 112.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.33
ACD/LogD (pH 5.5): -0.36
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.94
ACD/LogD (pH 7.4): 0.83
ACD/BCF (pH 7.4): 2.39
ACD/KOC (pH 7.4): 61.15
Polar Surface Area: 98 Å2
Polarizability: 44.4±0.5 10-24cm3
Surface Tension: 49.9±3.0 dyne/cm
Molar Volume: 344.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement