ChemSpider 2D Image | 2-({4-sec-Butyl-5-[3-(diethylsulfamoyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1-methoxy-2-propanyl)acetamide | C22H35N5O4S2

2-({4-sec-Butyl-5-[3-(diethylsulfamoyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1-methoxy-2-propanyl)acetamide

  • Molecular FormulaC22H35N5O4S2
  • Average mass497.674 Da
  • Monoisotopic mass497.213043 Da
  • ChemSpider ID21976508

More details:

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

2-({4-sec-Butyl-5-[3-(diethylsulfamoyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1-methoxy-2-propanyl)acetamid [German] [ACD/IUPAC Name]
2-({4-sec-Butyl-5-[3-(diethylsulfamoyl)phenyl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1-methoxy-2-propanyl)acetamide [ACD/IUPAC Name]
2-({4-sec-Butyl-5-[3-(diéthylsulfamoyl)phényl]-4H-1,2,4-triazol-3-yl}sulfanyl)-N-(1-méthoxy-2-propanyl)acétamide [French] [ACD/IUPAC Name]
Acetamide, 2-[[5-[3-[(diethylamino)sulfonyl]phenyl]-4-(1-methylpropyl)-4H-1,2,4-triazol-3-yl]thio]-N-(2-methoxy-1-methylethyl)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.591
Molar Refractivity: 134.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 13
#Rule of 5 Violations: 0
ACD/LogP: 4.24
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 202.30
ACD/KOC (pH 5.5): 1556.83
ACD/LogD (pH 7.4): 3.34
ACD/BCF (pH 7.4): 202.30
ACD/KOC (pH 7.4): 1556.85
Polar Surface Area: 140 Å2
Polarizability: 53.4±0.5 10-24cm3
Surface Tension: 45.0±7.0 dyne/cm
Molar Volume: 398.5±7.0 cm3

Click to predict properties on the Chemicalize site


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