ChemSpider 2D Image | N-(5-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonyl}-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-methylbutanamide | C23H27ClN4O3S

N-(5-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonyl}-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-methylbutanamide

  • Molecular FormulaC23H27ClN4O3S
  • Average mass475.004 Da
  • Monoisotopic mass474.149231 Da
  • ChemSpider ID22143283

More details:

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

Butanamide, N-[5-[[4-(3-chlorophenyl)-1-piperazinyl]carbonyl]-4,5,6,7-tetrahydro-7-oxo-2-benzothiazolyl]-2-methyl- [ACD/Index Name]
N-(5-{[4-(3-Chlorophenyl)-1-piperazinyl]carbonyl}-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-methylbutanamide [ACD/IUPAC Name]
N-(5-{[4-(3-Chlorophényl)-1-pipérazinyl]carbonyl}-7-oxo-4,5,6,7-tétrahydro-1,3-benzothiazol-2-yl)-2-méthylbutanamide [French] [ACD/IUPAC Name]
N-(5-{[4-(3-Chlorphenyl)-1-piperazinyl]carbonyl}-7-oxo-4,5,6,7-tetrahydro-1,3-benzothiazol-2-yl)-2-methylbutanamid [German] [ACD/IUPAC 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: 1.634
Molar Refractivity: 125.3±0.3 cm3
#H bond acceptors: 7
#H bond donors: 1
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 3.70
ACD/LogD (pH 5.5): 3.66
ACD/BCF (pH 5.5): 357.35
ACD/KOC (pH 5.5): 2339.11
ACD/LogD (pH 7.4): 3.66
ACD/BCF (pH 7.4): 352.55
ACD/KOC (pH 7.4): 2307.73
Polar Surface Area: 111 Å2
Polarizability: 49.7±0.5 10-24cm3
Surface Tension: 62.6±3.0 dyne/cm
Molar Volume: 350.5±3.0 cm3

Click to predict properties on the Chemicalize site


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