ChemSpider 2D Image | 1-(4-Chlorobenzyl)-N-{2-[4-(4-chloro-3-hydroxyphenyl)-5-(4-pyridinyl)-1H-imidazol-2-yl]-2-methylpropyl}-4-piperidinecarboxamide | C31H33Cl2N5O2

1-(4-Chlorobenzyl)-N-{2-[4-(4-chloro-3-hydroxyphenyl)-5-(4-pyridinyl)-1H-imidazol-2-yl]-2-methylpropyl}-4-piperidinecarboxamide

  • Molecular FormulaC31H33Cl2N5O2
  • Average mass578.532 Da
  • Monoisotopic mass577.201111 Da
  • ChemSpider ID25066696

More details:






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

1-(4-Chlorbenzyl)-N-{2-[4-(4-chlor-3-hydroxyphenyl)-5-(4-pyridinyl)-1H-imidazol-2-yl]-2-methylpropyl}-4-piperidincarboxamid [German] [ACD/IUPAC Name]
1-(4-Chlorobenzyl)-N-{2-[4-(4-chloro-3-hydroxyphenyl)-5-(4-pyridinyl)-1H-imidazol-2-yl]-2-methylpropyl}-4-piperidinecarboxamide [ACD/IUPAC Name]
1-(4-Chlorobenzyl)-N-{2-[4-(4-chloro-3-hydroxyphényl)-5-(4-pyridinyl)-1H-imidazol-2-yl]-2-méthylpropyl}-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
4-Piperidinecarboxamide, N-[2-[4-(4-chloro-3-hydroxyphenyl)-5-(4-pyridinyl)-1H-imidazol-2-yl]-2-methylpropyl]-1-[(4-chlorophenyl)methyl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 791.1±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 119.1±3.0 kJ/mol
Flash Point: 432.3±32.9 °C
Index of Refraction: 1.629
Molar Refractivity: 158.0±0.3 cm3
#H bond acceptors: 7
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 5.32
ACD/LogD (pH 5.5): 3.34
ACD/BCF (pH 5.5): 63.60
ACD/KOC (pH 5.5): 172.22
ACD/LogD (pH 7.4): 4.87
ACD/BCF (pH 7.4): 2172.80
ACD/KOC (pH 7.4): 5883.78
Polar Surface Area: 94 Å2
Polarizability: 62.6±0.5 10-24cm3
Surface Tension: 58.3±3.0 dyne/cm
Molar Volume: 444.6±3.0 cm3

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