ChemSpider 2D Image | 2,4,5-Trimethyl-N-[3-oxo-3-(1-piperazinyl)propyl]-N-[3-(1-pyrrolidinyl)propyl]benzenesulfonamide | C23H38N4O3S

2,4,5-Trimethyl-N-[3-oxo-3-(1-piperazinyl)propyl]-N-[3-(1-pyrrolidinyl)propyl]benzenesulfonamide

  • Molecular FormulaC23H38N4O3S
  • Average mass450.638 Da
  • Monoisotopic mass450.266449 Da
  • ChemSpider ID31085671

More details:

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

2,4,5-Trimethyl-N-[3-oxo-3-(1-piperazinyl)propyl]-N-[3-(1-pyrrolidinyl)propyl]benzenesulfonamide [ACD/IUPAC Name]
2,4,5-Triméthyl-N-[3-oxo-3-(1-pipérazinyl)propyl]-N-[3-(1-pyrrolidinyl)propyl]benzènesulfonamide [French] [ACD/IUPAC Name]
2,4,5-Trimethyl-N-[3-oxo-3-(1-piperazinyl)propyl]-N-[3-(1-pyrrolidinyl)propyl]benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 2,4,5-trimethyl-N-[3-oxo-3-(1-piperazinyl)propyl]-N-[3-(1-pyrrolidinyl)propyl]- [ACD/Index Name]
2,4,5-trimethyl-N-(3-oxo-3-piperazinopropyl)-N-[3-(1-pyrrolidinyl)propyl]-1-benzenesulfonamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 642.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.8±3.0 kJ/mol
Flash Point: 342.3±34.3 °C
Index of Refraction: 1.559
Molar Refractivity: 125.6±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.49
ACD/LogD (pH 5.5): -1.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.34
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 81 Å2
Polarizability: 49.8±0.5 10-24cm3
Surface Tension: 46.0±3.0 dyne/cm
Molar Volume: 388.9±3.0 cm3

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