ChemSpider 2D Image | 2-[(Benzylcarbamoyl)amino]-2-oxoethyl 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoate | C27H28N4O6S

2-[(Benzylcarbamoyl)amino]-2-oxoethyl 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoate

  • Molecular FormulaC27H28N4O6S
  • Average mass536.599 Da
  • Monoisotopic mass536.172974 Da
  • ChemSpider ID4037313

More details:

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

2-[(Benzylcarbamoyl)amino]-2-oxoethyl 3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoate [ACD/IUPAC Name]
2-[(Benzylcarbamoyl)amino]-2-oxoethyl-3-[(4-phenyl-1-piperazinyl)sulfonyl]benzoat [German] [ACD/IUPAC Name]
3-[(4-Phényl-1-pipérazinyl)sulfonyl]benzoate de 2-[(benzylcarbamoyl)amino]-2-oxoéthyle [French] [ACD/IUPAC Name]
Benzoic acid, 3-[(4-phenyl-1-piperazinyl)sulfonyl]-, 2-oxo-2-[[[(phenylmethyl)amino]carbonyl]amino]ethyl ester [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: 1.627
Molar Refractivity: 141.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 4.17
ACD/LogD (pH 5.5): 3.72
ACD/BCF (pH 5.5): 379.38
ACD/KOC (pH 5.5): 2315.20
ACD/LogD (pH 7.4): 3.80
ACD/BCF (pH 7.4): 451.86
ACD/KOC (pH 7.4): 2757.52
Polar Surface Area: 134 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 400.0±3.0 cm3

Click to predict properties on the Chemicalize site


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