ChemSpider 2D Image | 5-{[(4-Methylphenyl)sulfonyl](pentyl)amino}-1,3,4-thiadiazole-2-sulfonamide | C14H20N4O4S3

5-{[(4-Methylphenyl)sulfonyl](pentyl)amino}-1,3,4-thiadiazole-2-sulfonamide

  • Molecular FormulaC14H20N4O4S3
  • Average mass404.528 Da
  • Monoisotopic mass404.064667 Da
  • ChemSpider ID26398261

More details:

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

1,3,4-Thiadiazole-2-sulfonamide, 5-[[(4-methylphenyl)sulfonyl]pentylamino]- [ACD/Index Name]
5-{[(4-Methylphenyl)sulfonyl](pentyl)amino}-1,3,4-thiadiazol-2-sulfonamid [German] [ACD/IUPAC Name]
5-{[(4-Methylphenyl)sulfonyl](pentyl)amino}-1,3,4-thiadiazole-2-sulfonamide [ACD/IUPAC Name]
5-{[(4-Méthylphényl)sulfonyl](pentyl)amino}-1,3,4-thiadiazole-2-sulfonamide [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: 593.5±43.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.5±3.0 kJ/mol
Flash Point: 312.7±28.2 °C
Index of Refraction: 1.607
Molar Refractivity: 98.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.75
ACD/LogD (pH 5.5): 2.99
ACD/BCF (pH 5.5): 109.70
ACD/KOC (pH 5.5): 1001.33
ACD/LogD (pH 7.4): 2.71
ACD/BCF (pH 7.4): 58.04
ACD/KOC (pH 7.4): 529.75
Polar Surface Area: 168 Å2
Polarizability: 38.9±0.5 10-24cm3
Surface Tension: 64.5±3.0 dyne/cm
Molar Volume: 284.3±3.0 cm3

Click to predict properties on the Chemicalize site


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