ChemSpider 2D Image | 2-Oxo-2-{[4-(1-piperidinyl)phenyl]amino}ethyl 2-({[2-methyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}amino)benzoate | C31H37N3O5S

2-Oxo-2-{[4-(1-piperidinyl)phenyl]amino}ethyl 2-({[2-methyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}amino)benzoate

  • Molecular FormulaC31H37N3O5S
  • Average mass563.708 Da
  • Monoisotopic mass563.245361 Da
  • ChemSpider ID3517055

More details:

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

2-({[2-Méthyl-5-(2-méthyl-2-propanyl)phényl]sulfonyl}amino)benzoate de 2-oxo-2-{[4-(1-pipéridinyl)phényl]amino}éthyle [French] [ACD/IUPAC Name]
2-Oxo-2-{[4-(1-piperidinyl)phenyl]amino}ethyl 2-({[2-methyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}amino)benzoate [ACD/IUPAC Name]
2-Oxo-2-{[4-(1-piperidinyl)phenyl]amino}ethyl-2-({[2-methyl-5-(2-methyl-2-propanyl)phenyl]sulfonyl}amino)benzoat [German] [ACD/IUPAC Name]
Benzoic acid, 2-[[[5-(1,1-dimethylethyl)-2-methylphenyl]sulfonyl]amino]-, 2-oxo-2-[[4-(1-piperidinyl)phenyl]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: 1.613
Molar Refractivity: 156.3±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.55
ACD/LogD (pH 5.5): 6.07
ACD/BCF (pH 5.5): 20743.62
ACD/KOC (pH 5.5): 35496.59
ACD/LogD (pH 7.4): 6.24
ACD/BCF (pH 7.4): 30223.34
ACD/KOC (pH 7.4): 51718.33
Polar Surface Area: 113 Å2
Polarizability: 62.0±0.5 10-24cm3
Surface Tension: 55.3±3.0 dyne/cm
Molar Volume: 449.1±3.0 cm3

Click to predict properties on the Chemicalize site


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