ChemSpider 2D Image | N~2~-(2-Chloro-6-fluorobenzyl)-N-(4-phenoxyphenyl)-N~2~-(propylsulfonyl)valinamide | C27H30ClFN2O4S

N2-(2-Chloro-6-fluorobenzyl)-N-(4-phenoxyphenyl)-N2-(propylsulfonyl)valinamide

  • Molecular FormulaC27H30ClFN2O4S
  • Average mass533.055 Da
  • Monoisotopic mass532.159912 Da
  • ChemSpider ID124733837

More details:

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

Butanamide, 2-[[(2-chloro-6-fluorophenyl)methyl](propylsulfonyl)amino]-3-methyl-N-(4-phenoxyphenyl)- [ACD/Index Name]
N2-(2-Chlor-6-fluorbenzyl)-N-(4-phenoxyphenyl)-N2-(propylsulfonyl)valinamid [German] [ACD/IUPAC Name]
N2-(2-Chloro-6-fluorobenzyl)-N-(4-phenoxyphenyl)-N2-(propylsulfonyl)valinamide [ACD/IUPAC Name]
N2-(2-Chloro-6-fluorobenzyl)-N-(4-phénoxyphényl)-N2-(propylsulfonyl)valinamide [French] [ACD/IUPAC 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: 1.595
Molar Refractivity: 140.9±0.4 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 7.32
ACD/LogD (pH 5.5): 6.34
ACD/BCF (pH 5.5): 38515.81
ACD/KOC (pH 5.5): 66677.88
ACD/LogD (pH 7.4): 6.34
ACD/BCF (pH 7.4): 38516.19
ACD/KOC (pH 7.4): 66678.54
Polar Surface Area: 84 Å2
Polarizability: 55.9±0.5 10-24cm3
Surface Tension: 49.5±3.0 dyne/cm
Molar Volume: 414.6±3.0 cm3

Click to predict properties on the Chemicalize site


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