ChemSpider 2D Image | N-{5-[(2-Anilino-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(dipropylsulfamoyl)benzamide | C23H27N5O4S3

N-{5-[(2-Anilino-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(dipropylsulfamoyl)benzamide

  • Molecular FormulaC23H27N5O4S3
  • Average mass533.687 Da
  • Monoisotopic mass533.122498 Da
  • ChemSpider ID20896315

More details:

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

Benzamide, 4-[(dipropylamino)sulfonyl]-N-[5-[[2-oxo-2-(phenylamino)ethyl]thio]-1,3,4-thiadiazol-2-yl]- [ACD/Index Name]
N-{5-[(2-Anilino-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(dipropylsulfamoyl)benzamid [German] [ACD/IUPAC Name]
N-{5-[(2-Anilino-2-oxoethyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(dipropylsulfamoyl)benzamide [ACD/IUPAC Name]
N-{5-[(2-Anilino-2-oxoéthyl)sulfanyl]-1,3,4-thiadiazol-2-yl}-4-(dipropylsulfamoyl)benzamide [French] [ACD/IUPAC Name]
4-(N,N-dipropylsulfamoyl)-N-(5-((2-oxo-2-(phenylamino)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: 2
ACD/LogP: 5.29
ACD/LogD (pH 5.5): 4.30
ACD/BCF (pH 5.5): 1089.38
ACD/KOC (pH 5.5): 5191.00
ACD/LogD (pH 7.4): 4.21
ACD/BCF (pH 7.4): 887.12
ACD/KOC (pH 7.4): 4227.20
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

Click to predict properties on the Chemicalize site


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