ChemSpider 2D Image | N-[2-(Dimethylamino)ethyl]-1-{[4-(methylsulfanyl)phenyl]sulfonyl}-4-piperidinecarboxamide | C17H27N3O3S2

N-[2-(Dimethylamino)ethyl]-1-{[4-(methylsulfanyl)phenyl]sulfonyl}-4-piperidinecarboxamide

  • Molecular FormulaC17H27N3O3S2
  • Average mass385.545 Da
  • Monoisotopic mass385.149384 Da
  • ChemSpider ID29428896

More details:

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

4-Piperidinecarboxamide, N-[2-(dimethylamino)ethyl]-1-[[4-(methylthio)phenyl]sulfonyl]- [ACD/Index Name]
N-[2-(Dimethylamino)ethyl]-1-{[4-(methylsulfanyl)phenyl]sulfonyl}-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-[2-(Dimethylamino)ethyl]-1-{[4-(methylsulfanyl)phenyl]sulfonyl}-4-piperidinecarboxamide [ACD/IUPAC Name]
N-[2-(Diméthylamino)éthyl]-1-{[4-(méthylsulfanyl)phényl]sulfonyl}-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1-(4-Methylsulfanyl-benzenesulfonyl)-piperidine-4-carboxylic acid (2-dimethylamino-ethyl)-amide
N-[2-(dimethylamino)ethyl]-1-{[4-(methylsulfanyl)phenyl]sulfonyl}piperidine-4-carboxamide
N-[2-(dimethylamino)ethyl]-1-{[4-(methylthio)phenyl]sulfonyl}-4-piperidinecarboxamide

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: 1.604
Molar Refractivity: 104.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): -0.57
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 1.13
ACD/BCF (pH 7.4): 3.02
ACD/KOC (pH 7.4): 50.80
Polar Surface Area: 103 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 56.5±5.0 dyne/cm
Molar Volume: 302.5±5.0 cm3

Click to predict properties on the Chemicalize site


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