ChemSpider 2D Image | 2-{4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}-2-oxoethyl 3-acetamido-3-phenylpropanoate | C23H26ClN3O6S

2-{4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}-2-oxoethyl 3-acetamido-3-phenylpropanoate

  • Molecular FormulaC23H26ClN3O6S
  • Average mass507.987 Da
  • Monoisotopic mass507.123077 Da
  • ChemSpider ID21945351

More details:

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

2-{4-[(4-Chlorophenyl)sulfonyl]-1-piperazinyl}-2-oxoethyl 3-acetamido-3-phenylpropanoate [ACD/IUPAC Name]
2-{4-[(4-Chlorphenyl)sulfonyl]-1-piperazinyl}-2-oxoethyl-3-acetamido-3-phenylpropanoat [German] [ACD/IUPAC Name]
3-Acétamido-3-phénylpropanoate de 2-{4-[(4-chlorophényl)sulfonyl]-1-pipérazinyl}-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzenepropanoic acid, β-(acetylamino)-, 2-[4-[(4-chlorophenyl)sulfonyl]-1-piperazinyl]-2-oxoethyl ester [ACD/Index Name]

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: 1.600
Molar Refractivity: 127.5±0.4 cm3
#H bond acceptors: 9
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 2.67
ACD/LogD (pH 5.5): 2.34
ACD/BCF (pH 5.5): 35.34
ACD/KOC (pH 5.5): 446.50
ACD/LogD (pH 7.4): 2.34
ACD/BCF (pH 7.4): 35.34
ACD/KOC (pH 7.4): 446.51
Polar Surface Area: 121 Å2
Polarizability: 50.5±0.5 10-24cm3
Surface Tension: 56.3±3.0 dyne/cm
Molar Volume: 372.4±3.0 cm3

Click to predict properties on the Chemicalize site


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