ChemSpider 2D Image | 6-Ethoxy-4-({4-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl}methyl)-2H-chromen-2-one | C24H33N3O4

6-Ethoxy-4-({4-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl}methyl)-2H-chromen-2-one

  • Molecular FormulaC24H33N3O4
  • Average mass427.536 Da
  • Monoisotopic mass427.247101 Da
  • ChemSpider ID21638176

More details:

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

2H-1-Benzopyran-2-one, 6-ethoxy-4-[[4-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl]methyl]- [ACD/Index Name]
6-Ethoxy-4-({4-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl}methyl)-2H-chromen-2-on [German] [ACD/IUPAC Name]
6-Ethoxy-4-({4-[2-(3-methyl-1-piperidinyl)-2-oxoethyl]-1-piperazinyl}methyl)-2H-chromen-2-one [ACD/IUPAC Name]
6-Éthoxy-4-({4-[2-(3-méthyl-1-pipéridinyl)-2-oxoéthyl]-1-pipérazinyl}méthyl)-2H-chromén-2-one [French] [ACD/IUPAC Name]
6-ethoxy-4-({4-[2-(3-methylpiperidin-1-yl)-2-oxoethyl]piperazin-1-yl}methyl)-2H-chromen-2-one
6-ETHOXY-4-({4-[2-(3-METHYLPIPERIDIN-1-YL)-2-OXOETHYL]PIPERAZIN-1-YL}METHYL)CHROMEN-2-ONE
6-Ethoxy-4-{4-[2-(3-methyl-piperidin-1-yl)-2-oxo-ethyl]-piperazin-1-ylmethyl}-chromen-2-one
MFCD09779958

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

Density: 1.2±0.1 g/cm3
Boiling Point: 621.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.1±3.0 kJ/mol
Flash Point: 329.5±31.5 °C
Index of Refraction: 1.564
Molar Refractivity: 117.9±0.3 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.41
ACD/LogD (pH 5.5): 1.56
ACD/BCF (pH 5.5): 5.16
ACD/KOC (pH 5.5): 57.86
ACD/LogD (pH 7.4): 2.53
ACD/BCF (pH 7.4): 47.96
ACD/KOC (pH 7.4): 538.15
Polar Surface Area: 62 Å2
Polarizability: 46.7±0.5 10-24cm3
Surface Tension: 46.1±3.0 dyne/cm
Molar Volume: 362.6±3.0 cm3

Click to predict properties on the Chemicalize site


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