ChemSpider 2D Image | N-1H-Benzimidazol-6-yl-4-fluoro-Nalpha-{3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl}phenylalaninamide | C28H29FN6O4S

N-1H-Benzimidazol-6-yl-4-fluoro-Nα-{3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl}phenylalaninamide

  • Molecular FormulaC28H29FN6O4S
  • Average mass564.631 Da
  • Monoisotopic mass564.195496 Da
  • ChemSpider ID120672061

More details:

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

Benzenepropanamide, N-1H-benzimidazol-6-yl-4-fluoro-α-[[3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl]amino]- [ACD/Index Name]
N-1H-Benzimidazol-6-yl-4-fluor-Nα-{3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl}phenylalaninamid [German] [ACD/IUPAC Name]
N-1H-Benzimidazol-6-yl-4-fluoro-Nα-{3-[(4-methyl-1-piperazinyl)sulfonyl]benzoyl}phenylalaninamide [ACD/IUPAC Name]
N-1H-Benzimidazol-6-yl-4-fluoro-Nα-{3-[(4-méthyl-1-pipérazinyl)sulfonyl]benzoyl}phénylalaninamide [French] [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: 1.667
Molar Refractivity: 149.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 3
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 2.87
ACD/LogD (pH 5.5): 1.52
ACD/BCF (pH 5.5): 5.43
ACD/KOC (pH 5.5): 69.73
ACD/LogD (pH 7.4): 2.29
ACD/BCF (pH 7.4): 32.01
ACD/KOC (pH 7.4): 410.87
Polar Surface Area: 136 Å2
Polarizability: 59.2±0.5 10-24cm3
Surface Tension: 66.9±3.0 dyne/cm
Molar Volume: 401.1±3.0 cm3

Click to predict properties on the Chemicalize site


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