ChemSpider 2D Image | 1-({3-[1-(4-Methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl}methyl)-4-(2-pyridinylmethyl)piperazine | C25H31N5O

1-({3-[1-(4-Methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl}methyl)-4-(2-pyridinylmethyl)piperazine

  • Molecular FormulaC25H31N5O
  • Average mass417.547 Da
  • Monoisotopic mass417.252869 Da
  • ChemSpider ID22379630

More details:

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

1-({3-[1-(4-Methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl}methyl)-4-(2-pyridinylmethyl)piperazin [German] [ACD/IUPAC Name]
1-({3-[1-(4-Methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl}methyl)-4-(2-pyridinylmethyl)piperazine [ACD/IUPAC Name]
1-({3-[1-(4-Méthylphényl)cyclopentyl]-1,2,4-oxadiazol-5-yl}méthyl)-4-(2-pyridinylméthyl)pipérazine [French] [ACD/IUPAC Name]
Piperazine, 1-[[3-[1-(4-methylphenyl)cyclopentyl]-1,2,4-oxadiazol-5-yl]methyl]-4-(2-pyridinylmethyl)- [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: 575.3±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 86.2±3.0 kJ/mol
Flash Point: 301.7±32.9 °C
Index of Refraction: 1.607
Molar Refractivity: 120.9±0.3 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.03
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 64.94
ACD/KOC (pH 5.5): 532.47
ACD/LogD (pH 7.4): 3.20
ACD/BCF (pH 7.4): 158.86
ACD/KOC (pH 7.4): 1302.59
Polar Surface Area: 58 Å2
Polarizability: 47.9±0.5 10-24cm3
Surface Tension: 56.7±3.0 dyne/cm
Molar Volume: 350.0±3.0 cm3

Click to predict properties on the Chemicalize site


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