ChemSpider 2D Image | N-(4-Sulfamoylbenzyl)-N~3~-(2-thienylsulfonyl)-beta-alaninamide | C14H17N3O5S3

N-(4-Sulfamoylbenzyl)-N3-(2-thienylsulfonyl)-β-alaninamide

  • Molecular FormulaC14H17N3O5S3
  • Average mass403.497 Da
  • Monoisotopic mass403.033020 Da
  • ChemSpider ID66887214

More details:

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

N-(4-Sulfamoylbenzyl)-N3-(2-thienylsulfonyl)-β-alaninamid [German] [ACD/IUPAC Name]
N-(4-Sulfamoylbenzyl)-N3-(2-thienylsulfonyl)-β-alaninamide [ACD/IUPAC Name]
N-(4-Sulfamoylbenzyl)-N3-(2-thiénylsulfonyl)-β-alaninamide [French] [ACD/IUPAC Name]
Propanamide, N-[[4-(aminosulfonyl)phenyl]methyl]-3-[(2-thienylsulfonyl)amino]- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.623
Molar Refractivity: 96.8±0.4 cm3
#H bond acceptors: 8
#H bond donors: 4
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: -0.49
ACD/LogD (pH 5.5): 0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 28.31
ACD/LogD (pH 7.4): 0.14
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 28.21
Polar Surface Area: 180 Å2
Polarizability: 38.4±0.5 10-24cm3
Surface Tension: 62.3±3.0 dyne/cm
Molar Volume: 274.6±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement