ChemSpider 2D Image | 4-{[(1-Ethyl-3-methyl-4-nitro-1H-pyrazol-5-yl)carbonyl]amino}-N-(2-{[(4-methylphenyl)sulfonyl]amino}ethyl)-4-piperidinecarboxamide | C22H31N7O6S

4-{[(1-Ethyl-3-methyl-4-nitro-1H-pyrazol-5-yl)carbonyl]amino}-N-(2-{[(4-methylphenyl)sulfonyl]amino}ethyl)-4-piperidinecarboxamide

  • Molecular FormulaC22H31N7O6S
  • Average mass521.590 Da
  • Monoisotopic mass521.205627 Da
  • ChemSpider ID4173957

More details:

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

4-{[(1-Ethyl-3-methyl-4-nitro-1H-pyrazol-5-yl)carbonyl]amino}-N-(2-{[(4-methylphenyl)sulfonyl]amino}ethyl)-4-piperidincarboxamid [German] [ACD/IUPAC Name]
4-{[(1-Ethyl-3-methyl-4-nitro-1H-pyrazol-5-yl)carbonyl]amino}-N-(2-{[(4-methylphenyl)sulfonyl]amino}ethyl)-4-piperidinecarboxamide [ACD/IUPAC Name]
4-{[(1-Éthyl-3-méthyl-4-nitro-1H-pyrazol-5-yl)carbonyl]amino}-N-(2-{[(4-méthylphényl)sulfonyl]amino}éthyl)-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
4-Piperidinecarboxamide, 4-[[(1-ethyl-3-methyl-4-nitro-1H-pyrazol-5-yl)carbonyl]amino]-N-[2-[[(4-methylphenyl)sulfonyl]amino]ethyl]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.663
Molar Refractivity: 132.6±0.5 cm3
#H bond acceptors: 13
#H bond donors: 4
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 1.10
ACD/LogD (pH 5.5): -2.30
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.97
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 1.25
Polar Surface Area: 188 Å2
Polarizability: 52.6±0.5 10-24cm3
Surface Tension: 61.5±7.0 dyne/cm
Molar Volume: 358.0±7.0 cm3

Click to predict properties on the Chemicalize site


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