ChemSpider 2D Image | N-(3-Chloro-4-fluorobenzyl)-1-{[5-(1H-pyrazol-5-yl)-2-furyl]sulfonyl}-3-piperidinecarboxamide | C20H20ClFN4O4S

N-(3-Chloro-4-fluorobenzyl)-1-{[5-(1H-pyrazol-5-yl)-2-furyl]sulfonyl}-3-piperidinecarboxamide

  • Molecular FormulaC20H20ClFN4O4S
  • Average mass466.914 Da
  • Monoisotopic mass466.087769 Da
  • ChemSpider ID28969159

More details:






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

3-Piperidinecarboxamide, N-[(3-chloro-4-fluorophenyl)methyl]-1-[[5-(1H-pyrazol-5-yl)-2-furanyl]sulfonyl]- [ACD/Index Name]
N-(3-Chlor-4-fluorbenzyl)-1-{[5-(1H-pyrazol-5-yl)-2-furyl]sulfonyl}-3-piperidincarboxamid [German] [ACD/IUPAC Name]
N-(3-Chloro-4-fluorobenzyl)-1-{[5-(1H-pyrazol-5-yl)-2-furyl]sulfonyl}-3-piperidinecarboxamide [ACD/IUPAC Name]
N-(3-Chloro-4-fluorobenzyl)-1-{[5-(1H-pyrazol-5-yl)-2-furyl]sulfonyl}-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
N-(3-chloro-4-fluorobenzyl)-1-{[5-(1H-pyrazol-5-yl)-2-furyl]sulfonyl}piperidine-3-carboxamide

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.615
Molar Refractivity: 112.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.17
ACD/LogD (pH 5.5): 2.89
ACD/BCF (pH 5.5): 91.90
ACD/KOC (pH 5.5): 884.93
ACD/LogD (pH 7.4): 2.89
ACD/BCF (pH 7.4): 91.94
ACD/KOC (pH 7.4): 885.31
Polar Surface Area: 117 Å2
Polarizability: 44.5±0.5 10-24cm3
Surface Tension: 60.1±3.0 dyne/cm
Molar Volume: 321.3±3.0 cm3

Click to predict properties on the Chemicalize site






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