ChemSpider 2D Image | 4-[Benzyl(ethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-sulfamoyl-1,3-benzothiazol-2(3H)-ylidene]benzamide | C26H28N4O6S3

4-[Benzyl(ethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-sulfamoyl-1,3-benzothiazol-2(3H)-ylidene]benzamide

  • Molecular FormulaC26H28N4O6S3
  • Average mass588.719 Da
  • Monoisotopic mass588.117065 Da
  • ChemSpider ID35314365

More details:

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

4-[Benzyl(ethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-sulfamoyl-1,3-benzothiazol-2(3H)-yliden]benzamid [German] [ACD/IUPAC Name]
4-[Benzyl(ethyl)sulfamoyl]-N-[3-(2-methoxyethyl)-6-sulfamoyl-1,3-benzothiazol-2(3H)-ylidene]benzamide [ACD/IUPAC Name]
4-[Benzyl(éthyl)sulfamoyl]-N-[3-(2-méthoxyéthyl)-6-sulfamoyl-1,3-benzothiazol-2(3H)-ylidène]benzamide [French] [ACD/IUPAC Name]
Benzamide, N-[6-(aminosulfonyl)-3-(2-methoxyethyl)-2(3H)-benzothiazolylidene]-4-[[ethyl(phenylmethyl)amino]sulfonyl]- [ACD/Index Name]
4-[benzyl(ethyl)sulfamoyl]-N-[(2Z)-3-(2-methoxyethyl)-6-sulfamoyl-2,3-dihydro-1,3-benzothiazol-2-ylidene]benzamide
865160-73-2 [RN]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 799.2±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 116.2±3.0 kJ/mol
Flash Point: 437.1±35.7 °C
Index of Refraction: 1.663
Molar Refractivity: 154.2±0.5 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 3.61
ACD/LogD (pH 5.5): 3.52
ACD/BCF (pH 5.5): 277.48
ACD/KOC (pH 5.5): 1951.93
ACD/LogD (pH 7.4): 3.51
ACD/BCF (pH 7.4): 275.45
ACD/KOC (pH 7.4): 1937.62
Polar Surface Area: 182 Å2
Polarizability: 61.1±0.5 10-24cm3
Surface Tension: 59.3±7.0 dyne/cm
Molar Volume: 416.6±7.0 cm3

Click to predict properties on the Chemicalize site


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