ChemSpider 2D Image | [1-(3-Chlorophenoxy)cyclohexyl][4-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-1-piperazinyl]methanone | C25H33ClN4O2S

[1-(3-Chlorophenoxy)cyclohexyl][4-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-1-piperazinyl]methanone

  • Molecular FormulaC25H33ClN4O2S
  • Average mass489.073 Da
  • Monoisotopic mass488.201263 Da
  • ChemSpider ID67625423

More details:

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

[1-(3-Chlorophenoxy)cyclohexyl][4-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-1-piperazinyl]methanone [ACD/IUPAC Name]
[1-(3-Chlorophénoxy)cyclohexyl][4-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
[1-(3-Chlorphenoxy)cyclohexyl][4-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
Methanone, [1-(3-chlorophenoxy)cyclohexyl][4-(5-cyclohexyl-1,3,4-thiadiazol-2-yl)-1-piperazinyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 661.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.3±3.0 kJ/mol
Flash Point: 353.7±34.3 °C
Index of Refraction: 1.603
Molar Refractivity: 131.8±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 5.43
ACD/LogD (pH 5.5): 5.07
ACD/BCF (pH 5.5): 3656.05
ACD/KOC (pH 5.5): 10571.10
ACD/LogD (pH 7.4): 5.30
ACD/BCF (pH 7.4): 6278.30
ACD/KOC (pH 7.4): 18153.08
Polar Surface Area: 87 Å2
Polarizability: 52.2±0.5 10-24cm3
Surface Tension: 57.0±3.0 dyne/cm
Molar Volume: 383.5±3.0 cm3

Click to predict properties on the Chemicalize site


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