ChemSpider 2D Image | 3-{4-[(3-Bromophenyl)sulfonyl]-1-piperazinyl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide | C17H21BrN4O4S

3-{4-[(3-Bromophenyl)sulfonyl]-1-piperazinyl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide

  • Molecular FormulaC17H21BrN4O4S
  • Average mass457.342 Da
  • Monoisotopic mass456.046692 Da
  • ChemSpider ID22332302

More details:

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

1-Piperazinepropanamide, 4-[(3-bromophenyl)sulfonyl]-N-(5-methyl-3-isoxazolyl)- [ACD/Index Name]
3-{4-[(3-Bromophenyl)sulfonyl]-1-piperazinyl}-N-(5-methyl-1,2-oxazol-3-yl)propanamide [ACD/IUPAC Name]
3-{4-[(3-Bromophényl)sulfonyl]-1-pipérazinyl}-N-(5-méthyl-1,2-oxazol-3-yl)propanamide [French] [ACD/IUPAC Name]
3-{4-[(3-Bromphenyl)sulfonyl]-1-piperazinyl}-N-(5-methyl-1,2-oxazol-3-yl)propanamid [German] [ACD/IUPAC Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.617
Molar Refractivity: 104.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.14
ACD/LogD (pH 5.5): 2.09
ACD/BCF (pH 5.5): 19.52
ACD/KOC (pH 5.5): 241.06
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 37.85
ACD/KOC (pH 7.4): 467.43
Polar Surface Area: 104 Å2
Polarizability: 41.6±0.5 10-24cm3
Surface Tension: 60.3±3.0 dyne/cm
Molar Volume: 299.4±3.0 cm3

Click to predict properties on the Chemicalize site


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