ChemSpider 2D Image | (3S,5S)-1-Cyclohexyl-4-(dibenzylamino)-3,5-piperidinediol | C25H34N2O2

(3S,5S)-1-Cyclohexyl-4-(dibenzylamino)-3,5-piperidinediol

  • Molecular FormulaC25H34N2O2
  • Average mass394.550 Da
  • Monoisotopic mass394.262024 Da
  • ChemSpider ID30658714

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3S,5S)-1-Cyclohexyl-4-(dibenzylamino)-3,5-piperidindiol [German] [ACD/IUPAC Name]
(3S,5S)-1-Cyclohexyl-4-(dibenzylamino)-3,5-piperidinediol [ACD/IUPAC Name]
(3S,5S)-1-Cyclohexyl-4-(dibenzylamino)-3,5-pipéridinediol [French] [ACD/IUPAC Name]
3,5-Piperidinediol, 4-[bis(phenylmethyl)amino]-1-cyclohexyl-, (3S,5S)- [ACD/Index Name]

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

Density: 1.2±0.1 g/cm3
Boiling Point: 562.8±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 89.0±3.0 kJ/mol
Flash Point: 283.5±28.8 °C
Index of Refraction: 1.626
Molar Refractivity: 118.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 5.18
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 2.40
ACD/KOC (pH 5.5): 14.65
ACD/LogD (pH 7.4): 3.23
ACD/BCF (pH 7.4): 122.71
ACD/KOC (pH 7.4): 747.70
Polar Surface Area: 47 Å2
Polarizability: 46.9±0.5 10-24cm3
Surface Tension: 56.7±5.0 dyne/cm
Molar Volume: 334.5±5.0 cm3

Click to predict properties on the Chemicalize site


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