ChemSpider 2D Image | 4-(4-Methoxy-2,3-dimethylbenzyl)-3-{2-[4-(3-methoxypropyl)-1-piperidinyl]-2-oxoethyl}-2-piperazinone | C25H39N3O4

4-(4-Methoxy-2,3-dimethylbenzyl)-3-{2-[4-(3-methoxypropyl)-1-piperidinyl]-2-oxoethyl}-2-piperazinone

  • Molecular FormulaC25H39N3O4
  • Average mass445.595 Da
  • Monoisotopic mass445.294067 Da
  • ChemSpider ID22232787

More details:

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

2-Piperazinone, 4-[(4-methoxy-2,3-dimethylphenyl)methyl]-3-[2-[4-(3-methoxypropyl)-1-piperidinyl]-2-oxoethyl]- [ACD/Index Name]
4-(4-Methoxy-2,3-dimethylbenzyl)-3-{2-[4-(3-methoxypropyl)-1-piperidinyl]-2-oxoethyl}-2-piperazinon [German] [ACD/IUPAC Name]
4-(4-Methoxy-2,3-dimethylbenzyl)-3-{2-[4-(3-methoxypropyl)-1-piperidinyl]-2-oxoethyl}-2-piperazinone [ACD/IUPAC Name]
4-(4-Méthoxy-2,3-diméthylbenzyl)-3-{2-[4-(3-méthoxypropyl)-1-pipéridinyl]-2-oxoéthyl}-2-pipérazinone [French] [ACD/IUPAC Name]

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

Density: 1.1±0.1 g/cm3
Boiling Point: 637.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 94.1±3.0 kJ/mol
Flash Point: 339.2±31.5 °C
Index of Refraction: 1.528
Molar Refractivity: 125.2±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 1.74
ACD/LogD (pH 5.5): 1.45
ACD/BCF (pH 5.5): 5.13
ACD/KOC (pH 5.5): 71.51
ACD/LogD (pH 7.4): 2.12
ACD/BCF (pH 7.4): 23.85
ACD/KOC (pH 7.4): 332.44
Polar Surface Area: 71 Å2
Polarizability: 49.6±0.5 10-24cm3
Surface Tension: 40.9±3.0 dyne/cm
Molar Volume: 406.6±3.0 cm3

Click to predict properties on the Chemicalize site


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