ChemSpider 2D Image | (4-Benzyl-1-piperidinyl)[1-(4-chlorophenyl)-5-(3-pyridinyl)-1H-1,2,3-triazol-4-yl]methanone | C26H24ClN5O

(4-Benzyl-1-piperidinyl)[1-(4-chlorophenyl)-5-(3-pyridinyl)-1H-1,2,3-triazol-4-yl]methanone

  • Molecular FormulaC26H24ClN5O
  • Average mass457.955 Da
  • Monoisotopic mass457.166931 Da
  • ChemSpider ID26310316

More details:

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

(4-Benzyl-1-piperidinyl)[1-(4-chlorophenyl)-5-(3-pyridinyl)-1H-1,2,3-triazol-4-yl]methanone [ACD/IUPAC Name]
(4-Benzyl-1-pipéridinyl)[1-(4-chlorophényl)-5-(3-pyridinyl)-1H-1,2,3-triazol-4-yl]méthanone [French] [ACD/IUPAC Name]
(4-Benzyl-1-piperidinyl)[1-(4-chlorphenyl)-5-(3-pyridinyl)-1H-1,2,3-triazol-4-yl]methanon [German] [ACD/IUPAC Name]
Methanone, [1-(4-chlorophenyl)-5-(3-pyridinyl)-1H-1,2,3-triazol-4-yl][4-(phenylmethyl)-1-piperidinyl]- [ACD/Index Name]
(4-benzylpiperidin-1-yl)(1-(4-chlorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazol-4-yl)methanone
(4-benzylpiperidin-1-yl)[1-(4-chlorophenyl)-5-(pyridin-3-yl)-1H-1,2,3-triazol-4-yl]methanone
(4-Benzyl-piperidin-1-yl)-[1-(4-chloro-phenyl)-5-pyridin-3-yl-1H-[1,2,3]triazol-4-yl]-methanone
1207006-16-3 [RN]
3-[4-(4-benzylpiperidine-1-carbonyl)-1-(4-chlorophenyl)-1H-1,2,3-triazol-5-yl]pyridine

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

Density: 1.3±0.1 g/cm3
Boiling Point: 685.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 100.5±3.0 kJ/mol
Flash Point: 368.2±34.3 °C
Index of Refraction: 1.678
Molar Refractivity: 132.2±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.75
ACD/LogD (pH 5.5): 4.10
ACD/BCF (pH 5.5): 768.65
ACD/KOC (pH 5.5): 4038.43
ACD/LogD (pH 7.4): 4.10
ACD/BCF (pH 7.4): 774.78
ACD/KOC (pH 7.4): 4070.65
Polar Surface Area: 64 Å2
Polarizability: 52.4±0.5 10-24cm3
Surface Tension: 53.1±7.0 dyne/cm
Molar Volume: 350.5±7.0 cm3

Click to predict properties on the Chemicalize site


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