ChemSpider 2D Image | 2-(4-{4-[(6-Amino-3-pyridinyl)sulfonyl]-1-piperazinyl}phenyl)-1,1,1,3,3,3-hexafluoro-2-propanol | C18H18F6N4O3S

2-(4-{4-[(6-Amino-3-pyridinyl)sulfonyl]-1-piperazinyl}phenyl)-1,1,1,3,3,3-hexafluoro-2-propanol

  • Molecular FormulaC18H18F6N4O3S
  • Average mass484.416 Da
  • Monoisotopic mass484.100372 Da
  • ChemSpider ID31138039

More details:

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

2-(4-{4-[(6-Amino-3-pyridinyl)sulfonyl]-1-piperazinyl}phenyl)-1,1,1,3,3,3-hexafluor-2-propanol [German] [ACD/IUPAC Name]
2-(4-{4-[(6-Amino-3-pyridinyl)sulfonyl]-1-piperazinyl}phenyl)-1,1,1,3,3,3-hexafluoro-2-propanol [ACD/IUPAC Name]
2-(4-{4-[(6-Amino-3-pyridinyl)sulfonyl]-1-pipérazinyl}phényl)-1,1,1,3,3,3-hexafluoro-2-propanol [French] [ACD/IUPAC Name]
2-(4-{4-[(6-Aminopyridin-3-Yl)sulfonyl]piperazin-1-Yl}phenyl)-1,1,1,3,3,3-Hexafluoropropan-2-Ol
Benzenemethanol, 4-[4-[(6-amino-3-pyridinyl)sulfonyl]-1-piperazinyl]-α,α-bis(trifluoromethyl)- [ACD/Index Name]
MG0

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

Density: 1.5±0.1 g/cm3
Boiling Point: 615.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 96.0±3.0 kJ/mol
Flash Point: 326.2±34.3 °C
Index of Refraction: 1.560
Molar Refractivity: 102.1±0.4 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.68
ACD/LogD (pH 5.5): 2.74
ACD/BCF (pH 5.5): 70.17
ACD/KOC (pH 5.5): 709.68
ACD/LogD (pH 7.4): 2.79
ACD/BCF (pH 7.4): 76.98
ACD/KOC (pH 7.4): 778.59
Polar Surface Area: 108 Å2
Polarizability: 40.5±0.5 10-24cm3
Surface Tension: 50.7±3.0 dyne/cm
Molar Volume: 316.0±3.0 cm3

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