ChemSpider 2D Image | 1-{3-[4-(4-Methoxyphenyl)-1-piperazinyl]-1-piperidinyl}-3-(1,2-oxazinan-2-yl)-1-propanone | C23H36N4O3

1-{3-[4-(4-Methoxyphenyl)-1-piperazinyl]-1-piperidinyl}-3-(1,2-oxazinan-2-yl)-1-propanone

  • Molecular FormulaC23H36N4O3
  • Average mass416.557 Da
  • Monoisotopic mass416.278748 Da
  • ChemSpider ID22139953

More details:

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

1-{3-[4-(4-Methoxyphenyl)-1-piperazinyl]-1-piperidinyl}-3-(1,2-oxazinan-2-yl)-1-propanon [German] [ACD/IUPAC Name]
1-{3-[4-(4-Methoxyphenyl)-1-piperazinyl]-1-piperidinyl}-3-(1,2-oxazinan-2-yl)-1-propanone [ACD/IUPAC Name]
1-{3-[4-(4-Méthoxyphényl)-1-pipérazinyl]-1-pipéridinyl}-3-(1,2-oxazinan-2-yl)-1-propanone [French] [ACD/IUPAC Name]
1-Propanone, 1-[3-[4-(4-methoxyphenyl)-1-piperazinyl]-1-piperidinyl]-3-(tetrahydro-2H-1,2-oxazin-2-yl)- [ACD/Index Name]
2-(3-{3-[4-(4-methoxyphenyl)-1-piperazinyl]-1-piperidinyl}-3-oxopropyl)-1,2-oxazinane

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

Density: 1.2±0.1 g/cm3
Boiling Point: 596.8±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 88.9±3.0 kJ/mol
Flash Point: 314.7±32.9 °C
Index of Refraction: 1.562
Molar Refractivity: 116.8±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 1.52
ACD/LogD (pH 5.5): -0.09
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 4.08
ACD/LogD (pH 7.4): 1.34
ACD/BCF (pH 7.4): 5.62
ACD/KOC (pH 7.4): 108.12
Polar Surface Area: 48 Å2
Polarizability: 46.3±0.5 10-24cm3
Surface Tension: 47.1±3.0 dyne/cm
Molar Volume: 360.3±3.0 cm3

Click to predict properties on the Chemicalize site


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