ChemSpider 2D Image | N-(2-Chloro-4-methylphenyl)-1-{[2,5-dimethyl-4-(1-piperidinylcarbonyl)-1H-pyrrol-3-yl]sulfonyl}-4-piperidinecarboxamide | C25H33ClN4O4S

N-(2-Chloro-4-methylphenyl)-1-{[2,5-dimethyl-4-(1-piperidinylcarbonyl)-1H-pyrrol-3-yl]sulfonyl}-4-piperidinecarboxamide

  • Molecular FormulaC25H33ClN4O4S
  • Average mass521.072 Da
  • Monoisotopic mass520.191101 Da
  • ChemSpider ID29043709

More details:

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

4-Piperidinecarboxamide, N-(2-chloro-4-methylphenyl)-1-[[2,5-dimethyl-4-(1-piperidinylcarbonyl)-1H-pyrrol-3-yl]sulfonyl]- [ACD/Index Name]
N-(2-Chlor-4-methylphenyl)-1-{[2,5-dimethyl-4-(1-piperidinylcarbonyl)-1H-pyrrol-3-yl]sulfonyl}-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-(2-Chloro-4-methylphenyl)-1-{[2,5-dimethyl-4-(1-piperidinylcarbonyl)-1H-pyrrol-3-yl]sulfonyl}-4-piperidinecarboxamide [ACD/IUPAC Name]
N-(2-Chloro-4-méthylphényl)-1-{[2,5-diméthyl-4-(1-pipéridinylcarbonyl)-1H-pyrrol-3-yl]sulfonyl}-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-(2-chloro-4-methylphenyl)-1-{[2,5-dimethyl-4-(piperidin-1-ylcarbonyl)-1H-pyrrol-3-yl]sulfonyl}piperidine-4-carboxamide

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: 1.619
Molar Refractivity: 136.0±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 2.20
ACD/LogD (pH 5.5): 3.16
ACD/BCF (pH 5.5): 149.42
ACD/KOC (pH 5.5): 1253.31
ACD/LogD (pH 7.4): 3.16
ACD/BCF (pH 7.4): 149.42
ACD/KOC (pH 7.4): 1253.31
Polar Surface Area: 111 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 60.2±3.0 dyne/cm
Molar Volume: 387.6±3.0 cm3

Click to predict properties on the Chemicalize site


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