ChemSpider 2D Image | N-[2-(Butylamino)-5-sulfamoylphenyl]-3-chloro-4-methoxybenzenesulfonamide | C17H22ClN3O5S2

N-[2-(Butylamino)-5-sulfamoylphenyl]-3-chloro-4-methoxybenzenesulfonamide

  • Molecular FormulaC17H22ClN3O5S2
  • Average mass447.957 Da
  • Monoisotopic mass447.068939 Da
  • ChemSpider ID34294916

More details:

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

Benzenesulfonamide, N-[5-(aminosulfonyl)-2-(butylamino)phenyl]-3-chloro-4-methoxy- [ACD/Index Name]
N-[2-(Butylamino)-5-sulfamoylphenyl]-3-chlor-4-methoxybenzolsulfonamid [German] [ACD/IUPAC Name]
N-[2-(Butylamino)-5-sulfamoylphenyl]-3-chloro-4-methoxybenzenesulfonamide [ACD/IUPAC Name]
N-[2-(Butylamino)-5-sulfamoylphényl]-3-chloro-4-méthoxybenzènesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 640.8±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.6±3.0 kJ/mol
Flash Point: 341.3±34.3 °C
Index of Refraction: 1.620
Molar Refractivity: 109.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.58
ACD/LogD (pH 5.5): 3.27
ACD/BCF (pH 5.5): 180.33
ACD/KOC (pH 5.5): 1431.44
ACD/LogD (pH 7.4): 3.11
ACD/BCF (pH 7.4): 125.00
ACD/KOC (pH 7.4): 992.28
Polar Surface Area: 144 Å2
Polarizability: 43.5±0.5 10-24cm3
Surface Tension: 61.7±3.0 dyne/cm
Molar Volume: 312.4±3.0 cm3

Click to predict properties on the Chemicalize site


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