ChemSpider 2D Image | N-(4-Acetylphenyl)-2-({5-[3-(diethylsulfamoyl)phenyl]-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide | C30H33N5O4S2

N-(4-Acetylphenyl)-2-({5-[3-(diethylsulfamoyl)phenyl]-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide

  • Molecular FormulaC30H33N5O4S2
  • Average mass591.744 Da
  • Monoisotopic mass591.197388 Da
  • ChemSpider ID2913426

More details:

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

Acetamide, N-(4-acetylphenyl)-2-[[5-[3-[(diethylamino)sulfonyl]phenyl]-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl]thio]- [ACD/Index Name]
N-(4-Acetylphenyl)-2-({5-[3-(diethylsulfamoyl)phenyl]-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamid [German] [ACD/IUPAC Name]
N-(4-Acetylphenyl)-2-({5-[3-(diethylsulfamoyl)phenyl]-4-(2-phenylethyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acetamide [ACD/IUPAC Name]
N-(4-Acétylphényl)-2-({5-[3-(diéthylsulfamoyl)phényl]-4-(2-phényléthyl)-4H-1,2,4-triazol-3-yl}sulfanyl)acétamide [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.638
Molar Refractivity: 166.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 2
ACD/LogP: 6.81
ACD/LogD (pH 5.5): 5.02
ACD/BCF (pH 5.5): 3827.11
ACD/KOC (pH 5.5): 12770.60
ACD/LogD (pH 7.4): 5.02
ACD/BCF (pH 7.4): 3827.11
ACD/KOC (pH 7.4): 12770.61
Polar Surface Area: 148 Å2
Polarizability: 66.0±0.5 10-24cm3
Surface Tension: 51.5±7.0 dyne/cm
Molar Volume: 463.1±7.0 cm3

Click to predict properties on the Chemicalize site


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