ChemSpider 2D Image | 1-[(3-{[4-(2-Ethoxyphenyl)-1-piperazinyl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)carbonyl]-4-piperidinecarboxamide | C23H32N6O5S

1-[(3-{[4-(2-Ethoxyphenyl)-1-piperazinyl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)carbonyl]-4-piperidinecarboxamide

  • Molecular FormulaC23H32N6O5S
  • Average mass504.602 Da
  • Monoisotopic mass504.215485 Da
  • ChemSpider ID27317402

More details:

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

1-[(3-{[4-(2-Ethoxyphenyl)-1-piperazinyl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)carbonyl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
1-[(3-{[4-(2-Ethoxyphenyl)-1-piperazinyl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)carbonyl]-4-piperidinecarboxamide [ACD/IUPAC Name]
1-[(3-{[4-(2-Éthoxyphényl)-1-pipérazinyl]sulfonyl}-1-méthyl-1H-pyrazol-4-yl)carbonyl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
4-Piperidinecarboxamide, 1-[[3-[[4-(2-ethoxyphenyl)-1-piperazinyl]sulfonyl]-1-methyl-1H-pyrazol-4-yl]carbonyl]- [ACD/Index Name]
1-[(3-{[4-(2-ethoxyphenyl)piperazin-1-yl]sulfonyl}-1-methyl-1H-pyrazol-4-yl)carbonyl]piperidine-4-carboxamide
1-{3-[4-(2-Ethoxy-phenyl)-piperazine-1-sulfonyl]-1-methyl-1H-pyrazole-4-carbonyl}-piperidine-4-carboxylic acid amide

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

Density: 1.4±0.1 g/cm3
Boiling Point: 788.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 114.7±3.0 kJ/mol
Flash Point: 430.6±35.7 °C
Index of Refraction: 1.669
Molar Refractivity: 131.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -1.31
ACD/LogD (pH 5.5): 0.37
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 26.09
ACD/LogD (pH 7.4): 0.72
ACD/BCF (pH 7.4): 2.05
ACD/KOC (pH 7.4): 57.97
Polar Surface Area: 139 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 60.5±7.0 dyne/cm
Molar Volume: 352.6±7.0 cm3

Click to predict properties on the Chemicalize site


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