ChemSpider 2D Image | N,N'-[1,4-Piperazinediylbis(4,4-dimethyl-6-oxo-1-cyclohexene-2,1-diyl)]dibenzamide | C34H40N4O4

N,N'-[1,4-Piperazinediylbis(4,4-dimethyl-6-oxo-1-cyclohexene-2,1-diyl)]dibenzamide

  • Molecular FormulaC34H40N4O4
  • Average mass568.706 Da
  • Monoisotopic mass568.304932 Da
  • ChemSpider ID1020754

More details:

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

Benzamide, N,N'-[1,4-piperazinediylbis(4,4-dimethyl-6-oxo-1-cyclohexene-2,1-diyl)]bis- [ACD/Index Name]
N,N'-[1,4-Piperazindiylbis(4,4-dimethyl-6-oxo-1-cyclohexen-2,1-diyl)]dibenzamid [German] [ACD/IUPAC Name]
N,N'-[1,4-Piperazinediylbis(4,4-dimethyl-6-oxo-1-cyclohexene-2,1-diyl)]dibenzamide [ACD/IUPAC Name]
N,N'-[1,4-Pipérazinediylbis(4,4-diméthyl-6-oxo-1-cyclohexène-2,1-diyl)]dibenzamide [French] [ACD/IUPAC Name]
N-(2-{4-[2-(benzoylamino)-5,5-dimethyl-3-oxo-1-cyclohexen-1-yl]-1-piperazinyl}-4,4-dimethyl-6-oxo-1-cyclohexen-1-yl)benzamide

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

AI-559/14806011 [DBID]
ZINC00984367 [DBID]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 767.7±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 111.8±3.0 kJ/mol
Flash Point: 418.1±32.9 °C
Index of Refraction: 1.633
Molar Refractivity: 161.7±0.4 cm3
#H bond acceptors: 8
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 3.65
ACD/LogD (pH 5.5): 2.29
ACD/BCF (pH 5.5): 16.38
ACD/KOC (pH 5.5): 114.21
ACD/LogD (pH 7.4): 3.44
ACD/BCF (pH 7.4): 228.97
ACD/KOC (pH 7.4): 1596.43
Polar Surface Area: 99 Å2
Polarizability: 64.1±0.5 10-24cm3
Surface Tension: 58.9±5.0 dyne/cm
Molar Volume: 452.4±5.0 cm3

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