ChemSpider 2D Image | N~2~-[4-(Aminomethyl)benzyl]-N~2~-[(4-fluoro-3-methylphenyl)sulfonyl]-N-hydroxy-D-alaninamide | C18H22FN3O4S

N2-[4-(Aminomethyl)benzyl]-N2-[(4-fluoro-3-methylphenyl)sulfonyl]-N-hydroxy-D-alaninamide

  • Molecular FormulaC18H22FN3O4S
  • Average mass395.448 Da
  • Monoisotopic mass395.131500 Da
  • ChemSpider ID35035027
  • defined stereocentres - 1 of 1 defined stereocentres


More details:






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

N2-[4-(Aminomethyl)benzyl]-N2-[(4-fluor-3-methylphenyl)sulfonyl]-N-hydroxy-D-alaninamid [German] [ACD/IUPAC Name]
N2-[4-(Aminomethyl)benzyl]-N2-[(4-fluoro-3-methylphenyl)sulfonyl]-N-hydroxy-D-alaninamide [ACD/IUPAC Name]
N2-[4-(Aminométhyl)benzyl]-N2-[(4-fluoro-3-méthylphényl)sulfonyl]-N-hydroxy-D-alaninamide [French] [ACD/IUPAC Name]
Propanamide, 2-[[[4-(aminomethyl)phenyl]methyl][(4-fluoro-3-methylphenyl)sulfonyl]amino]-N-hydroxy-, (2R)- [ACD/Index Name]
30R

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.605
Molar Refractivity: 100.9±0.4 cm3
#H bond acceptors: 7
#H bond donors: 4
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 2.06
ACD/LogD (pH 5.5): -1.64
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.30
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.99
Polar Surface Area: 121 Å2
Polarizability: 40.0±0.5 10-24cm3
Surface Tension: 57.2±3.0 dyne/cm
Molar Volume: 293.0±3.0 cm3

Click to predict properties on the Chemicalize site






Advertisement