ChemSpider 2D Image | 2-{[3-(Dimethylsulfamoyl)phenyl]amino}-2-oxoethyl (2E)-3-(1,3-diphenyl-1H-pyrazol-4-yl)acrylate | C28H26N4O5S

2-{[3-(Dimethylsulfamoyl)phenyl]amino}-2-oxoethyl (2E)-3-(1,3-diphenyl-1H-pyrazol-4-yl)acrylate

  • Molecular FormulaC28H26N4O5S
  • Average mass530.595 Da
  • Monoisotopic mass530.162415 Da
  • ChemSpider ID4734933

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-3-(1,3-Diphényl-1H-pyrazol-4-yl)acrylate de 2-{[3-(diméthylsulfamoyl)phényl]amino}-2-oxoéthyle [French] [ACD/IUPAC Name]
2-{[3-(Dimethylsulfamoyl)phenyl]amino}-2-oxoethyl (2E)-3-(1,3-diphenyl-1H-pyrazol-4-yl)acrylate [ACD/IUPAC Name]
2-{[3-(Dimethylsulfamoyl)phenyl]amino}-2-oxoethyl-(2E)-3-(1,3-diphenyl-1H-pyrazol-4-yl)acrylat [German] [ACD/IUPAC Name]
2-Propenoic acid, 3-(1,3-diphenyl-1H-pyrazol-4-yl)-, 2-[[3-[(dimethylamino)sulfonyl]phenyl]amino]-2-oxoethyl ester, (2E)- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.623
Molar Refractivity: 147.9±0.5 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 4.13
ACD/LogD (pH 5.5): 4.24
ACD/BCF (pH 5.5): 989.75
ACD/KOC (pH 5.5): 4850.61
ACD/LogD (pH 7.4): 4.24
ACD/BCF (pH 7.4): 989.72
ACD/KOC (pH 7.4): 4850.49
Polar Surface Area: 119 Å2
Polarizability: 58.6±0.5 10-24cm3
Surface Tension: 51.1±7.0 dyne/cm
Molar Volume: 419.2±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement