ChemSpider 2D Image | 2-{[5-(2-Cyclohexylidenehydrazino)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-{4-[(4-methylphenyl)sulfamoyl]phenyl}acetamide | C23H27N7O3S2

2-{[5-(2-Cyclohexylidenehydrazino)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-{4-[(4-methylphenyl)sulfamoyl]phenyl}acetamide

  • Molecular FormulaC23H27N7O3S2
  • Average mass513.636 Da
  • Monoisotopic mass513.161682 Da
  • ChemSpider ID62599436

More details:

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

2-{[5-(2-Cyclohexylidenehydrazino)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-{4-[(4-methylphenyl)sulfamoyl]phenyl}acetamide [ACD/IUPAC Name]
2-{[5-(2-Cyclohexylidènehydrazino)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-{4-[(4-méthylphényl)sulfamoyl]phényl}acétamide [French] [ACD/IUPAC Name]
2-{[5-(2-Cyclohexylidenhydrazino)-1H-1,2,4-triazol-3-yl]sulfanyl}-N-{4-[(4-methylphenyl)sulfamoyl]phenyl}acetamid [German] [ACD/IUPAC Name]
Acetamide, 2-[[5-(2-cyclohexylidenehydrazinyl)-1H-1,2,4-triazol-3-yl]thio]-N-[4-[[(4-methylphenyl)amino]sulfonyl]phenyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.711
Molar Refractivity: 138.0±0.5 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.98
ACD/LogD (pH 5.5): 4.09
ACD/BCF (pH 5.5): 753.09
ACD/KOC (pH 5.5): 3982.70
ACD/LogD (pH 7.4): 4.08
ACD/BCF (pH 7.4): 737.85
ACD/KOC (pH 7.4): 3902.11
Polar Surface Area: 175 Å2
Polarizability: 54.7±0.5 10-24cm3
Surface Tension: 62.3±7.0 dyne/cm
Molar Volume: 352.5±7.0 cm3

Click to predict properties on the Chemicalize site


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