ChemSpider 2D Image | (1R)-1-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl {4-[4-(3,4-dichlorophenyl)-1-piperazinyl]phenyl}carbamate | C28H25Cl4N5O2

(1R)-1-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl {4-[4-(3,4-dichlorophenyl)-1-piperazinyl]phenyl}carbamate

  • Molecular FormulaC28H25Cl4N5O2
  • Average mass605.342 Da
  • Monoisotopic mass603.076233 Da
  • ChemSpider ID35034009

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(1R)-1-(2,4-Dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl {4-[4-(3,4-dichlorophenyl)-1-piperazinyl]phenyl}carbamate [ACD/IUPAC Name]
(1r)-1-(2,4-Dichlorophenyl)-2-(1h-Imidazol-1-Yl)ethyl {4-[4-(3,4-Dichlorophenyl)piperazin-1-Yl]phenyl}carbamate
(1R)-1-(2,4-Dichlorphenyl)-2-(1H-imidazol-1-yl)ethyl-{4-[4-(3,4-dichlorphenyl)-1-piperazinyl]phenyl}carbamat [German] [ACD/IUPAC Name]
{4-[4-(3,4-Dichlorophényl)-1-pipérazinyl]phényl}carbamate de (1R)-1-(2,4-dichlorophényl)-2-(1H-imidazol-1-yl)éthyle [French] [ACD/IUPAC Name]
Carbamic acid, N-[4-[4-(3,4-dichlorophenyl)-1-piperazinyl]phenyl]-, (1R)-1-(2,4-dichlorophenyl)-2-(1H-imidazol-1-yl)ethyl ester [ACD/Index Name]
LFD

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

Density: 1.4±0.1 g/cm3
Boiling Point: 759.9±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.7±3.0 kJ/mol
Flash Point: 413.4±32.9 °C
Index of Refraction: 1.667
Molar Refractivity: 157.5±0.5 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 6.55
ACD/LogD (pH 5.5): 4.60
ACD/BCF (pH 5.5): 674.60
ACD/KOC (pH 5.5): 1125.38
ACD/LogD (pH 7.4): 6.34
ACD/BCF (pH 7.4): 36883.21
ACD/KOC (pH 7.4): 61529.18
Polar Surface Area: 63 Å2
Polarizability: 62.4±0.5 10-24cm3
Surface Tension: 53.5±7.0 dyne/cm
Molar Volume: 422.8±7.0 cm3

Click to predict properties on the Chemicalize site


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