ChemSpider 2D Image | [4-(3,5-Dichlorobenzoyl)-1-piperazinyl][1-(2-pyrimidinyl)-3-piperidinyl]methanone | C21H23Cl2N5O2

[4-(3,5-Dichlorobenzoyl)-1-piperazinyl][1-(2-pyrimidinyl)-3-piperidinyl]methanone

  • Molecular FormulaC21H23Cl2N5O2
  • Average mass448.346 Da
  • Monoisotopic mass447.122894 Da
  • ChemSpider ID22807877

More details:

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

[4-(3,5-Dichlorbenzoyl)-1-piperazinyl][1-(2-pyrimidinyl)-3-piperidinyl]methanon [German] [ACD/IUPAC Name]
[4-(3,5-Dichlorobenzoyl)-1-piperazinyl][1-(2-pyrimidinyl)-3-piperidinyl]methanone [ACD/IUPAC Name]
[4-(3,5-Dichlorobenzoyl)-1-pipérazinyl][1-(2-pyrimidinyl)-3-pipéridinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [4-(3,5-dichlorobenzoyl)-1-piperazinyl][1-(2-pyrimidinyl)-3-piperidinyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 698.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.2±3.0 kJ/mol
Flash Point: 376.0±34.3 °C
Index of Refraction: 1.625
Molar Refractivity: 114.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.73
ACD/LogD (pH 5.5): 2.84
ACD/BCF (pH 5.5): 77.60
ACD/KOC (pH 5.5): 709.65
ACD/LogD (pH 7.4): 2.99
ACD/BCF (pH 7.4): 109.63
ACD/KOC (pH 7.4): 1002.65
Polar Surface Area: 70 Å2
Polarizability: 45.5±0.5 10-24cm3
Surface Tension: 62.0±3.0 dyne/cm
Molar Volume: 324.9±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement