ChemSpider 2D Image | 4-(Diethylsulfamoyl)-N-[5-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide | C23H27N5O4S3

4-(Diethylsulfamoyl)-N-[5-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide

  • Molecular FormulaC23H27N5O4S3
  • Average mass533.687 Da
  • Monoisotopic mass533.122498 Da
  • ChemSpider ID20894788

More details:






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

4-(Diethylsulfamoyl)-N-[5-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamid [German] [ACD/IUPAC Name]
4-(Diethylsulfamoyl)-N-[5-({2-oxo-2-[(2-phenylethyl)amino]ethyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide [ACD/IUPAC Name]
4-(Diéthylsulfamoyl)-N-[5-({2-oxo-2-[(2-phényléthyl)amino]éthyl}sulfanyl)-1,3,4-thiadiazol-2-yl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 4-[(diethylamino)sulfonyl]-N-[5-[[2-oxo-2-[(2-phenylethyl)amino]ethyl]thio]-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]
4-(N,N-diethylsulfamoyl)-N-(5-((2-oxo-2-(phenethylamino)ethyl)thio)-1,3,4-thiadiazol-2-yl)benzamide

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: 1.659
Molar Refractivity: 139.8±0.4 cm3
#H bond acceptors: 9
#H bond donors: 2
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 1
ACD/LogP: 4.27
ACD/LogD (pH 5.5): 3.65
ACD/BCF (pH 5.5): 353.03
ACD/KOC (pH 5.5): 2316.91
ACD/LogD (pH 7.4): 3.55
ACD/BCF (pH 7.4): 279.02
ACD/KOC (pH 7.4): 1831.19
Polar Surface Area: 183 Å2
Polarizability: 55.4±0.5 10-24cm3
Surface Tension: 73.3±5.0 dyne/cm
Molar Volume: 379.2±5.0 cm3

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