ChemSpider 2D Image | 3-Bromo-N-[2-({[4-(1-piperidinyl)phenyl]carbamothioyl}amino)ethyl]benzamide | C21H25BrN4OS

3-Bromo-N-[2-({[4-(1-piperidinyl)phenyl]carbamothioyl}amino)ethyl]benzamide

  • Molecular FormulaC21H25BrN4OS
  • Average mass461.418 Da
  • Monoisotopic mass460.093231 Da
  • ChemSpider ID59478521

More details:

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

3-Brom-N-[2-({[4-(1-piperidinyl)phenyl]carbamothioyl}amino)ethyl]benzamid [German] [ACD/IUPAC Name]
3-Bromo-N-[2-({[4-(1-piperidinyl)phenyl]carbamothioyl}amino)ethyl]benzamide [ACD/IUPAC Name]
3-Bromo-N-[2-({[4-(1-pipéridinyl)phényl]carbamothioyl}amino)éthyl]benzamide [French] [ACD/IUPAC Name]
Benzamide, 3-bromo-N-[2-[[[[4-(1-piperidinyl)phenyl]amino]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: 1.662
Molar Refractivity: 121.7±0.3 cm3
#H bond acceptors: 5
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 3.63
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 94.21
ACD/KOC (pH 5.5): 769.91
ACD/LogD (pH 7.4): 3.21
ACD/BCF (pH 7.4): 162.23
ACD/KOC (pH 7.4): 1325.81
Polar Surface Area: 88 Å2
Polarizability: 48.3±0.5 10-24cm3
Surface Tension: 61.4±3.0 dyne/cm
Molar Volume: 328.9±3.0 cm3

Click to predict properties on the Chemicalize site


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