ChemSpider 2D Image | N-{1-[(4-Butylphenyl)amino]-3-methyl-1-oxo-2-butanyl}-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide | C28H39N3O4S

N-{1-[(4-Butylphenyl)amino]-3-methyl-1-oxo-2-butanyl}-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide

  • Molecular FormulaC28H39N3O4S
  • Average mass513.692 Da
  • Monoisotopic mass513.266113 Da
  • ChemSpider ID3077011

More details:

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

4-Piperidinecarboxamide, N-[1-[[(4-butylphenyl)amino]carbonyl]-2-methylpropyl]-1-[(4-methylphenyl)sulfonyl]- [ACD/Index Name]
N-{1-[(4-Butylphenyl)amino]-3-methyl-1-oxo-2-butanyl}-1-[(4-methylphenyl)sulfonyl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-{1-[(4-Butylphenyl)amino]-3-methyl-1-oxo-2-butanyl}-1-[(4-methylphenyl)sulfonyl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-{1-[(4-Butylphényl)amino]-3-méthyl-1-oxo-2-butanyl}-1-[(4-méthylphényl)sulfonyl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-(4-BUTYLPHENYL)-3-METHYL-2-{[1-(4-METHYLBENZENESULFONYL)PIPERIDIN-4-YL]FORMAMIDO}BUTANAMIDE
N-{1-[(4-butylphenyl)amino]-3-methyl-1-oxobutan-2-yl}-1-[(4-methylphenyl)sulfonyl]piperidine-4-carboxamide

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

Density: 1.2±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.575
Molar Refractivity: 143.7±0.4 cm3
#H bond acceptors: 7
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 5.48
ACD/LogD (pH 5.5): 5.01
ACD/BCF (pH 5.5): 3782.72
ACD/KOC (pH 5.5): 12664.39
ACD/LogD (pH 7.4): 5.01
ACD/BCF (pH 7.4): 3782.77
ACD/KOC (pH 7.4): 12664.56
Polar Surface Area: 104 Å2
Polarizability: 57.0±0.5 10-24cm3
Surface Tension: 49.4±3.0 dyne/cm
Molar Volume: 434.7±3.0 cm3

Click to predict properties on the Chemicalize site


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