ChemSpider 2D Image | 2-[(4-Allyl-5-cyclohexyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-[(butylcarbamoyl)sulfamoyl]phenyl}acetamide | C24H34N6O4S2

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

  • Molecular FormulaC24H34N6O4S2
  • Average mass534.695 Da
  • Monoisotopic mass534.208313 Da
  • ChemSpider ID2861415

More details:

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

2-[(4-Allyl-5-cyclohexyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-[(butylcarbamoyl)sulfamoyl]phenyl}acetamid [German] [ACD/IUPAC Name]
2-[(4-Allyl-5-cyclohexyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-[(butylcarbamoyl)sulfamoyl]phenyl}acetamide [ACD/IUPAC Name]
2-[(4-Allyl-5-cyclohexyl-4H-1,2,4-triazol-3-yl)sulfanyl]-N-{4-[(butylcarbamoyl)sulfamoyl]phényl}acétamide [French] [ACD/IUPAC Name]
Acetamide, N-[4-[[[(butylamino)carbonyl]amino]sulfonyl]phenyl]-2-[[5-cyclohexyl-4-(2-propen-1-yl)-4H-1,2,4-triazol-3-yl]thio]- [ACD/Index 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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.648
Molar Refractivity: 143.6±0.5 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 4.93
ACD/LogD (pH 5.5): 2.91
ACD/BCF (pH 5.5): 60.56
ACD/KOC (pH 5.5): 377.58
ACD/LogD (pH 7.4): 1.84
ACD/BCF (pH 7.4): 5.06
ACD/KOC (pH 7.4): 31.55
Polar Surface Area: 169 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 55.2±7.0 dyne/cm
Molar Volume: 394.9±7.0 cm3

Click to predict properties on the Chemicalize site


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