ChemSpider 2D Image | 2-{4-[(4,5-Dibromo-2-thienyl)carbonyl]-1-piperazinyl}-N-methylacetamide | C12H15Br2N3O2S

2-{4-[(4,5-Dibromo-2-thienyl)carbonyl]-1-piperazinyl}-N-methylacetamide

  • Molecular FormulaC12H15Br2N3O2S
  • Average mass425.139 Da
  • Monoisotopic mass422.925171 Da
  • ChemSpider ID48494908

More details:

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

1-Piperazineacetamide, 4-[(4,5-dibromo-2-thienyl)carbonyl]-N-methyl- [ACD/Index Name]
2-{4-[(4,5-Dibrom-2-thienyl)carbonyl]-1-piperazinyl}-N-methylacetamid [German] [ACD/IUPAC Name]
2-{4-[(4,5-Dibromo-2-thienyl)carbonyl]-1-piperazinyl}-N-methylacetamide [ACD/IUPAC Name]
2-{4-[(4,5-Dibromo-2-thiényl)carbonyl]-1-pipérazinyl}-N-méthylacétamide [French] [ACD/IUPAC Name]

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

Density: 1.7±0.1 g/cm3
Boiling Point: 586.7±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.6 mmHg at 25°C
Enthalpy of Vaporization: 87.6±3.0 kJ/mol
Flash Point: 308.6±30.1 °C
Index of Refraction: 1.617
Molar Refractivity: 86.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 3
#Rule of 5 Violations: 0
ACD/LogP: 2.23
ACD/LogD (pH 5.5): 2.03
ACD/BCF (pH 5.5): 20.35
ACD/KOC (pH 5.5): 297.30
ACD/LogD (pH 7.4): 2.05
ACD/BCF (pH 7.4): 21.19
ACD/KOC (pH 7.4): 309.62
Polar Surface Area: 81 Å2
Polarizability: 34.3±0.5 10-24cm3
Surface Tension: 54.7±3.0 dyne/cm
Molar Volume: 247.5±3.0 cm3

Click to predict properties on the Chemicalize site


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