ChemSpider 2D Image | 2-[6-(4-Acetamidophenyl)-1,3-benzothiazol-2-yl]-2-(benzylsulfonyl)-N-(2-sulfamoylethyl)acetamide | C26H26N4O6S3

2-[6-(4-Acetamidophenyl)-1,3-benzothiazol-2-yl]-2-(benzylsulfonyl)-N-(2-sulfamoylethyl)acetamide

  • Molecular FormulaC26H26N4O6S3
  • Average mass586.703 Da
  • Monoisotopic mass586.101440 Da
  • ChemSpider ID58870714

More details:

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

2-[6-(4-Acetamidophenyl)-1,3-benzothiazol-2-yl]-2-(benzylsulfonyl)-N-(2-sulfamoylethyl)acetamid [German] [ACD/IUPAC Name]
2-[6-(4-Acetamidophenyl)-1,3-benzothiazol-2-yl]-2-(benzylsulfonyl)-N-(2-sulfamoylethyl)acetamide [ACD/IUPAC Name]
2-[6-(4-Acétamidophényl)-1,3-benzothiazol-2-yl]-2-(benzylsulfonyl)-N-(2-sulfamoyléthyl)acétamide [French] [ACD/IUPAC Name]
2-Benzothiazoleacetamide, 6-[4-(acetylamino)phenyl]-N-[2-(aminosulfonyl)ethyl]-α-[(phenylmethyl)sulfonyl]- [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: 1.678
Molar Refractivity: 150.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 1.73
ACD/BCF (pH 5.5): 12.23
ACD/KOC (pH 5.5): 208.91
ACD/LogD (pH 7.4): 1.73
ACD/BCF (pH 7.4): 12.21
ACD/KOC (pH 7.4): 208.58
Polar Surface Area: 210 Å2
Polarizability: 59.8±0.5 10-24cm3
Surface Tension: 70.8±3.0 dyne/cm
Molar Volume: 400.1±3.0 cm3

Click to predict properties on the Chemicalize site


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