ChemSpider 2D Image | N-(4-Butylphenyl)-N~2~-[(5-chloro-2-methoxyphenyl)sulfonyl]-N~2~-(2-fluorobenzyl)alaninamide | C27H30ClFN2O4S

N-(4-Butylphenyl)-N2-[(5-chloro-2-methoxyphenyl)sulfonyl]-N2-(2-fluorobenzyl)alaninamide

  • Molecular FormulaC27H30ClFN2O4S
  • Average mass533.055 Da
  • Monoisotopic mass532.159912 Da
  • ChemSpider ID124736351

More details:

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

N-(4-Butylphenyl)-N2-[(5-chlor-2-methoxyphenyl)sulfonyl]-N2-(2-fluorbenzyl)alaninamid [German] [ACD/IUPAC Name]
N-(4-Butylphenyl)-N2-[(5-chloro-2-methoxyphenyl)sulfonyl]-N2-(2-fluorobenzyl)alaninamide [ACD/IUPAC Name]
N-(4-Butylphényl)-N2-[(5-chloro-2-méthoxyphényl)sulfonyl]-N2-(2-fluorobenzyl)alaninamide [French] [ACD/IUPAC Name]
Propanamide, N-(4-butylphenyl)-2-[[(5-chloro-2-methoxyphenyl)sulfonyl][(2-fluorophenyl)methyl]amino]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.593
Molar Refractivity: 141.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 8.16
ACD/LogD (pH 5.5): 6.37
ACD/BCF (pH 5.5): 40723.06
ACD/KOC (pH 5.5): 69391.19
ACD/LogD (pH 7.4): 6.37
ACD/BCF (pH 7.4): 40723.73
ACD/KOC (pH 7.4): 69392.33
Polar Surface Area: 84 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 50.8±3.0 dyne/cm
Molar Volume: 416.0±3.0 cm3

Click to predict properties on the Chemicalize site


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