ChemSpider 2D Image | N-{[4-({[(4-Isopropoxyphenyl)sulfonyl]carbamothioyl}amino)phenyl]sulfonyl}acetamide | C18H21N3O6S3

N-{[4-({[(4-Isopropoxyphenyl)sulfonyl]carbamothioyl}amino)phenyl]sulfonyl}acetamide

  • Molecular FormulaC18H21N3O6S3
  • Average mass471.571 Da
  • Monoisotopic mass471.059235 Da
  • ChemSpider ID66454955

More details:

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

Acetamide, N-[[4-[[[[[4-(1-methylethoxy)phenyl]sulfonyl]amino]thioxomethyl]amino]phenyl]sulfonyl]- [ACD/Index Name]
N-{[4-({[(4-Isopropoxyphenyl)sulfonyl]carbamothioyl}amino)phenyl]sulfonyl}acetamid [German] [ACD/IUPAC Name]
N-{[4-({[(4-Isopropoxyphenyl)sulfonyl]carbamothioyl}amino)phenyl]sulfonyl}acetamide [ACD/IUPAC Name]
N-{[4-({[(4-Isopropoxyphényl)sulfonyl]carbamothioyl}amino)phényl]sulfonyl}acétamide [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.625
Molar Refractivity: 116.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 2.55
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 2.09
ACD/LogD (pH 7.4): -0.77
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 180 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 62.3±3.0 dyne/cm
Molar Volume: 330.5±3.0 cm3

Click to predict properties on the Chemicalize site


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