ChemSpider 2D Image | N-{2-[(2-Hydroxy-2-methylpropyl)sulfanyl]ethyl}-N~3~-(2-nitro-4-sulfamoylphenyl)-beta-alaninamide | C15H24N4O6S2

N-{2-[(2-Hydroxy-2-methylpropyl)sulfanyl]ethyl}-N3-(2-nitro-4-sulfamoylphenyl)-β-alaninamide

  • Molecular FormulaC15H24N4O6S2
  • Average mass420.504 Da
  • Monoisotopic mass420.113739 Da
  • ChemSpider ID30233123

More details:

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

N-{2-[(2-Hydroxy-2-methylpropyl)sulfanyl]ethyl}-N3-(2-nitro-4-sulfamoylphenyl)-β-alaninamid [German] [ACD/IUPAC Name]
N-{2-[(2-Hydroxy-2-methylpropyl)sulfanyl]ethyl}-N3-(2-nitro-4-sulfamoylphenyl)-β-alaninamide [ACD/IUPAC Name]
N-{2-[(2-Hydroxy-2-méthylpropyl)sulfanyl]éthyl}-N3-(2-nitro-4-sulfamoylphényl)-β-alaninamide [French] [ACD/IUPAC Name]
Propanamide, 3-[[4-(aminosulfonyl)-2-nitrophenyl]amino]-N-[2-[(2-hydroxy-2-methylpropyl)thio]ethyl]- [ACD/Index Name]
N-{2-[(2-HYDROXY-2-METHYLPROPYL)SULFANYL]ETHYL}-3-[(2-NITRO-4-SULFAMOYLPHENYL)AMINO]PROPANAMIDE

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: 1.611
Molar Refractivity: 103.9±0.4 cm3
#H bond acceptors: 10
#H bond donors: 5
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 0.44
ACD/LogD (pH 5.5): 0.94
ACD/BCF (pH 5.5): 3.04
ACD/KOC (pH 5.5): 77.07
ACD/LogD (pH 7.4): 0.93
ACD/BCF (pH 7.4): 3.02
ACD/KOC (pH 7.4): 76.56
Polar Surface Area: 201 Å2
Polarizability: 41.2±0.5 10-24cm3
Surface Tension: 67.1±3.0 dyne/cm
Molar Volume: 299.2±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement