ChemSpider 2D Image | 2-[(5Z)-5-({3-[3-(Diethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid | C25H26N4O6S4

2-[(5Z)-5-({3-[3-(Diethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid

  • Molecular FormulaC25H26N4O6S4
  • Average mass606.757 Da
  • Monoisotopic mass606.073486 Da
  • ChemSpider ID4837703

  • Double-bond stereo - Double-bond stereo

More details:

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

2-[(5Z)-5-({3-[3-(Diethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylen)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethansulfonsäure [German] [ACD/IUPAC Name]
2-[(5Z)-5-({3-[3-(Diethylsulfamoyl)phenyl]-1-phenyl-1H-pyrazol-4-yl}methylene)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]ethanesulfonic acid [ACD/IUPAC Name]
3-Thiazolidineethanesulfonic acid, 5-[[3-[3-[(diethylamino)sulfonyl]phenyl]-1-phenyl-1H-pyrazol-4-yl]methylene]-4-oxo-2-thioxo-, (5Z)- [ACD/Index Name]
Acide 2-[(5Z)-5-({3-[3-(diéthylsulfamoyl)phényl]-1-phényl-1H-pyrazol-4-yl}méthylène)-4-oxo-2-thioxo-1,3-thiazolidin-3-yl]éthanesulfonique [French] [ACD/IUPAC 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: 1.691
Molar Refractivity: 158.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 2.32
ACD/LogD (pH 5.5): -2.10
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -2.19
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.00
Polar Surface Area: 204 Å2
Polarizability: 62.8±0.5 10-24cm3
Surface Tension: 61.5±7.0 dyne/cm
Molar Volume: 414.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement