ChemSpider 2D Image | [4,5-Bis(4-bromophenyl)-2-(2-ethoxy-4-methoxyphenyl)-4,5-dihydro-1H-imidazol-1-yl][4-(2-hydroxyethyl)-1-piperazinyl]methanone | C31H34Br2N4O4

[4,5-Bis(4-bromophenyl)-2-(2-ethoxy-4-methoxyphenyl)-4,5-dihydro-1H-imidazol-1-yl][4-(2-hydroxyethyl)-1-piperazinyl]methanone

  • Molecular FormulaC31H34Br2N4O4
  • Average mass686.434 Da
  • Monoisotopic mass684.094666 Da
  • ChemSpider ID8253868

More details:

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

[4,5-Bis(4-bromophenyl)-2-(2-ethoxy-4-methoxyphenyl)-4,5-dihydro-1H-imidazol-1-yl][4-(2-hydroxyethyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
[4,5-Bis(4-bromophényl)-2-(2-éthoxy-4-méthoxyphényl)-4,5-dihydro-1H-imidazol-1-yl][4-(2-hydroxyéthyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
[4,5-Bis(4-bromphenyl)-2-(2-ethoxy-4-methoxyphenyl)-4,5-dihydro-1H-imidazol-1-yl][4-(2-hydroxyethyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
CIS-[4,5-BIS-(4-BROMOPHENYL)-2-(2-ETHOXY-4-METHOXYPHENYL)-4,5-DIHYDROIMIDAZOL-1-YL]-[4-(2-HYDROXYETHYL)PIPERAZIN-1-YL]METHANONE
Methanone, [4,5-bis(4-bromophenyl)-2-(2-ethoxy-4-methoxyphenyl)-4,5-dihydro-1H-imidazol-1-yl][4-(2-hydroxyethyl)-1-piperazinyl]- [ACD/Index Name]
Nutlin-2

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

Density: 1.5±0.1 g/cm3
Boiling Point: 738.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 113.0±3.0 kJ/mol
Flash Point: 400.3±35.7 °C
Index of Refraction: 1.652
Molar Refractivity: 166.8±0.5 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: 4.52
ACD/LogD (pH 5.5): 4.07
ACD/BCF (pH 5.5): 470.67
ACD/KOC (pH 5.5): 1693.30
ACD/LogD (pH 7.4): 4.84
ACD/BCF (pH 7.4): 2760.40
ACD/KOC (pH 7.4): 9930.96
Polar Surface Area: 78 Å2
Polarizability: 66.1±0.5 10-24cm3
Surface Tension: 51.3±7.0 dyne/cm
Molar Volume: 456.2±7.0 cm3

Click to predict properties on the Chemicalize site


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