ChemSpider 2D Image | Cyclohexyl{3-[(4-{[4-(3-pyridinylmethyl)-1-piperazinyl]methyl}phenoxy)methyl]-1-piperidinyl}methanone | C30H42N4O2

Cyclohexyl{3-[(4-{[4-(3-pyridinylmethyl)-1-piperazinyl]methyl}phenoxy)methyl]-1-piperidinyl}methanone

  • Molecular FormulaC30H42N4O2
  • Average mass490.680 Da
  • Monoisotopic mass490.330780 Da
  • ChemSpider ID23053759

More details:

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

Cyclohexyl{3-[(4-{[4-(3-pyridinylmethyl)-1-piperazinyl]methyl}phenoxy)methyl]-1-piperidinyl}methanon [German] [ACD/IUPAC Name]
Cyclohexyl{3-[(4-{[4-(3-pyridinylmethyl)-1-piperazinyl]methyl}phenoxy)methyl]-1-piperidinyl}methanone [ACD/IUPAC Name]
Cyclohexyl{3-[(4-{[4-(3-pyridinylméthyl)-1-pipérazinyl]méthyl}phénoxy)méthyl]-1-pipéridinyl}méthanone [French] [ACD/IUPAC Name]
Methanone, cyclohexyl[3-[[4-[[4-(3-pyridinylmethyl)-1-piperazinyl]methyl]phenoxy]methyl]-1-piperidinyl]- [ACD/Index Name]
1-({4-[(1-CYCLOHEXANECARBONYLPIPERIDIN-3-YL)METHOXY]PHENYL}METHYL)-4-(PYRIDIN-3-YLMETHYL)PIPERAZINE
1-({4-[(1-CYCLOHEXANECARBONYLPIPERIDIN-3-YL)METHOXY]PHENYL}METHYL)-4-[(PYRIDIN-3-YL)METHYL]PIPERAZINE
1-(4-{[1-(cyclohexylcarbonyl)-3-piperidinyl]methoxy}benzyl)-4-(3-pyridinylmethyl)piperazine

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

Density: 1.1±0.1 g/cm3
Boiling Point: 655.4±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.5±3.0 kJ/mol
Flash Point: 350.2±30.1 °C
Index of Refraction: 1.583
Molar Refractivity: 143.6±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.06
ACD/LogD (pH 5.5): 1.83
ACD/BCF (pH 5.5): 6.10
ACD/KOC (pH 5.5): 45.99
ACD/LogD (pH 7.4): 3.25
ACD/BCF (pH 7.4): 161.21
ACD/KOC (pH 7.4): 1215.23
Polar Surface Area: 49 Å2
Polarizability: 56.9±0.5 10-24cm3
Surface Tension: 50.3±3.0 dyne/cm
Molar Volume: 429.7±3.0 cm3

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