ChemSpider 2D Image | 2-(4-Bromophenyl)-N-(2-{[(4-phenyl-1-piperazinyl)carbonothioyl]amino}ethyl)acetamide | C21H25BrN4OS

2-(4-Bromophenyl)-N-(2-{[(4-phenyl-1-piperazinyl)carbonothioyl]amino}ethyl)acetamide

  • Molecular FormulaC21H25BrN4OS
  • Average mass461.418 Da
  • Monoisotopic mass460.093231 Da
  • ChemSpider ID59458340

More details:

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

2-(4-Bromophenyl)-N-(2-{[(4-phenyl-1-piperazinyl)carbonothioyl]amino}ethyl)acetamide [ACD/IUPAC Name]
2-(4-Bromophényl)-N-(2-{[(4-phényl-1-pipérazinyl)carbonothioyl]amino}éthyl)acétamide [French] [ACD/IUPAC Name]
2-(4-Bromphenyl)-N-(2-{[(4-phenyl-1-piperazinyl)carbonothioyl]amino}ethyl)acetamid [German] [ACD/IUPAC Name]
Benzeneacetamide, 4-bromo-N-[2-[[(4-phenyl-1-piperazinyl)thioxomethyl]amino]ethyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.639
Molar Refractivity: 119.8±0.3 cm3
#H bond acceptors: 5
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 2.26
ACD/LogD (pH 5.5): 2.71
ACD/BCF (pH 5.5): 67.15
ACD/KOC (pH 5.5): 696.00
ACD/LogD (pH 7.4): 2.74
ACD/BCF (pH 7.4): 70.90
ACD/KOC (pH 7.4): 734.86
Polar Surface Area: 80 Å2
Polarizability: 47.5±0.5 10-24cm3
Surface Tension: 58.4±3.0 dyne/cm
Molar Volume: 333.0±3.0 cm3

Click to predict properties on the Chemicalize site


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