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Search term: PHKBBSFNOLKHIM (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4-(1,1-Dioxido-1,2-thiazinan-2-yl)-N-{[1-(4-fluorophenyl)cyclopropyl]methyl}benzenesulfonamide | C20H23FN2O4S2

4-(1,1-Dioxido-1,2-thiazinan-2-yl)-N-{[1-(4-fluorophenyl)cyclopropyl]methyl}benzenesulfonamide

  • Molecular FormulaC20H23FN2O4S2
  • Average mass438.536 Da
  • Monoisotopic mass438.108337 Da
  • ChemSpider ID30675725

More details:

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

4-(1,1-Dioxido-1,2-thiazinan-2-yl)-N-{[1-(4-fluorophenyl)cyclopropyl]methyl}benzenesulfonamide [ACD/IUPAC Name]
4-(1,1-Dioxido-1,2-thiazinan-2-yl)-N-{[1-(4-fluorphenyl)cyclopropyl]methyl}benzolsulfonamid [German] [ACD/IUPAC Name]
4-(1,1-Dioxydo-1,2-thiazinan-2-yl)-N-{[1-(4-fluorophényl)cyclopropyl]méthyl}benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, N-[[1-(4-fluorophenyl)cyclopropyl]methyl]-4-(tetrahydro-1,1-dioxido-2H-1,2-thiazin-2-yl)- [ACD/Index Name]
1396633-43-4 [RN]
4-(1,1-dioxido-1,2-thiazinan-2-yl)-N-((1-(4-fluorophenyl)cyclopropyl)methyl)benzenesulfonamide
4-(1,1-dioxo-1λ6,2-thiazinan-2-yl)-N-{[1-(4-fluorophenyl)cyclopropyl]methyl}benzene-1-sulfonamide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 604.6±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 89.9±3.0 kJ/mol
Flash Point: 319.5±34.3 °C
Index of Refraction: 1.614
Molar Refractivity: 109.7±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.71
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 95.11
ACD/KOC (pH 5.5): 907.05
ACD/LogD (pH 7.4): 2.90
ACD/BCF (pH 7.4): 95.10
ACD/KOC (pH 7.4): 906.89
Polar Surface Area: 100 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 54.3±3.0 dyne/cm
Molar Volume: 315.0±3.0 cm3

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