ChemSpider 2D Image | 2-[4-(~2~H_5_)Ethyl(3-~2~H_1_)-1-piperazinyl]-N-{4-[2-(4-morpholinyl)-4-oxo-4H-chromen-8-yl]dibenzo[b,d]thiophen-1-yl}acetamide | C33H28D6N4O4S

2-[4-(2H5)Ethyl(3-2H1)-1-piperazinyl]-N-{4-[2-(4-morpholinyl)-4-oxo-4H-chromen-8-yl]dibenzo[b,d]thiophen-1-yl}acetamide

  • Molecular FormulaC33H28D6N4O4S
  • Average mass588.749 Da
  • Monoisotopic mass588.267761 Da
  • ChemSpider ID128918638

  • Non-standard isotope - Non-standard isotope

More details:

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

2-[4-(2H5)Ethyl(3-2H1)-1-piperazinyl]-N-{4-[2-(4-morpholinyl)-4-oxo-4H-chromen-8-yl]dibenzo[b,d]thiophen-1-yl}acetamid [German] [ACD/IUPAC Name]
2-[4-(2H5)Ethyl(3-2H1)-1-piperazinyl]-N-{4-[2-(4-morpholinyl)-4-oxo-4H-chromen-8-yl]dibenzo[b,d]thiophen-1-yl}acetamide [ACD/IUPAC Name]
2-[4-(2H5)Éthyl(3-2H1)-1-pipérazinyl]-N-{4-[2-(4-morpholinyl)-4-oxo-4H-chromén-8-yl]dibenzo[b,d]thiophén-1-yl}acétamide [French] [ACD/IUPAC Name]
Piperazine-3-d-1-acetamide, 4-(ethyl-d5)-N-[4-[2-(4-morpholinyl)-4-oxo-4H-1-benzopyran-8-yl]dibenzo[b,d]thien-1-yl]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 819.9±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 119.2±3.0 kJ/mol
Flash Point: 449.7±34.3 °C
Index of Refraction: 1.694
Molar Refractivity: 167.3±0.3 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 5.56
ACD/LogD (pH 5.5): 2.57
ACD/BCF (pH 5.5): 17.56
ACD/KOC (pH 5.5): 72.93
ACD/LogD (pH 7.4): 4.20
ACD/BCF (pH 7.4): 749.07
ACD/KOC (pH 7.4): 3111.73
Polar Surface Area: 103 Å2
Polarizability: 66.3±0.5 10-24cm3
Surface Tension: 61.9±3.0 dyne/cm
Molar Volume: 435.6±3.0 cm3

Click to predict properties on the Chemicalize site


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