ChemSpider 2D Image | 2,4,6-Trimethyl-N-[3-methyl-1-(3-methyl-4-octanoyl-1-piperazinyl)-1-oxo-2-pentanyl]benzenesulfonamide | C28H47N3O4S

2,4,6-Trimethyl-N-[3-methyl-1-(3-methyl-4-octanoyl-1-piperazinyl)-1-oxo-2-pentanyl]benzenesulfonamide

  • Molecular FormulaC28H47N3O4S
  • Average mass521.755 Da
  • Monoisotopic mass521.328735 Da
  • ChemSpider ID4311254

More details:

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

2,4,6-Trimethyl-N-[3-methyl-1-(3-methyl-4-octanoyl-1-piperazinyl)-1-oxo-2-pentanyl]benzenesulfonamide [ACD/IUPAC Name]
2,4,6-Triméthyl-N-[3-méthyl-1-(3-méthyl-4-octanoyl-1-pipérazinyl)-1-oxo-2-pentanyl]benzènesulfonamide [French] [ACD/IUPAC Name]
2,4,6-Trimethyl-N-[3-methyl-1-(3-methyl-4-octanoyl-1-piperazinyl)-1-oxo-2-pentanyl]benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 2,4,6-trimethyl-N-[2-methyl-1-[[3-methyl-4-(1-oxooctyl)-1-piperazinyl]carbonyl]butyl]- [ACD/Index Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 675.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.2±3.0 kJ/mol
Flash Point: 362.4±34.3 °C
Index of Refraction: 1.523
Molar Refractivity: 147.0±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.74
ACD/LogD (pH 5.5): 6.29
ACD/BCF (pH 5.5): 35294.12
ACD/KOC (pH 5.5): 62636.13
ACD/LogD (pH 7.4): 6.28
ACD/BCF (pH 7.4): 35205.53
ACD/KOC (pH 7.4): 62478.91
Polar Surface Area: 95 Å2
Polarizability: 58.3±0.5 10-24cm3
Surface Tension: 40.8±3.0 dyne/cm
Molar Volume: 480.7±3.0 cm3

Click to predict properties on the Chemicalize site


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