ChemSpider 2D Image | N-[4-(2-{4-[3-Cyano-5-(trifluoromethyl)phenyl]-1-piperazinyl}ethyl)cyclohexyl]-3-pyridinesulfonamide | C25H30F3N5O2S

N-[4-(2-{4-[3-Cyano-5-(trifluoromethyl)phenyl]-1-piperazinyl}ethyl)cyclohexyl]-3-pyridinesulfonamide

  • Molecular FormulaC25H30F3N5O2S
  • Average mass521.598 Da
  • Monoisotopic mass521.207214 Da
  • ChemSpider ID8318308

More details:

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

3-Pyridinesulfonamide, N-[4-[2-[4-[3-cyano-5-(trifluoromethyl)phenyl]-1-piperazinyl]ethyl]cyclohexyl]- [ACD/Index Name]
N-[4-(2-{4-[3-Cyan-5-(trifluormethyl)phenyl]-1-piperazinyl}ethyl)cyclohexyl]-3-pyridinsulfonamid [German] [ACD/IUPAC Name]
N-[4-(2-{4-[3-Cyano-5-(trifluoromethyl)phenyl]-1-piperazinyl}ethyl)cyclohexyl]-3-pyridinesulfonamide [ACD/IUPAC Name]
N-[4-(2-{4-[3-Cyano-5-(trifluorométhyl)phényl]-1-pipérazinyl}éthyl)cyclohexyl]-3-pyridinesulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 652.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.1±3.0 kJ/mol
Flash Point: 348.2±34.3 °C
Index of Refraction: 1.599
Molar Refractivity: 130.5±0.4 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 4.59
ACD/LogD (pH 5.5): 2.30
ACD/BCF (pH 5.5): 11.80
ACD/KOC (pH 5.5): 60.97
ACD/LogD (pH 7.4): 3.86
ACD/BCF (pH 7.4): 429.12
ACD/KOC (pH 7.4): 2217.79
Polar Surface Area: 98 Å2
Polarizability: 51.7±0.5 10-24cm3
Surface Tension: 59.7±5.0 dyne/cm
Molar Volume: 381.8±5.0 cm3

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