Found 1 result

Search term: Nc1nc(Nc2ccc(cc2)S(N)(=O)=O)sc1C(=O)c1ccc(cc1)S(N)(=O)=O (Found by conversion of search term to chemical structure (full match))
ChemSpider 2D Image | 4-{[4-Amino-5-(4-sulfamoylbenzoyl)-1,3-thiazol-2-yl]amino}benzenesulfonamide | C16H15N5O5S3

4-{[4-Amino-5-(4-sulfamoylbenzoyl)-1,3-thiazol-2-yl]amino}benzenesulfonamide

  • Molecular FormulaC16H15N5O5S3
  • Average mass453.516 Da
  • Monoisotopic mass453.023529 Da
  • ChemSpider ID30811051

More details:

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

4-{[4-Amino-5-(4-sulfamoylbenzoyl)-1,3-thiazol-2-yl]amino}benzenesulfonamide [ACD/IUPAC Name]
4-{[4-Amino-5-(4-sulfamoylbenzoyl)-1,3-thiazol-2-yl]amino}benzènesulfonamide [French] [ACD/IUPAC Name]
4-{[4-Amino-5-(4-sulfamoylbenzoyl)-1,3-thiazol-2-yl]amino}benzolsulfonamid [German] [ACD/IUPAC Name]
Benzenesulfonamide, 4-[[4-amino-5-[4-(aminosulfonyl)benzoyl]-2-thiazolyl]amino]- [ACD/Index Name]
X44

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

Density: 1.6±0.1 g/cm3
Boiling Point: 807.8±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 117.4±3.0 kJ/mol
Flash Point: 442.3±37.1 °C
Index of Refraction: 1.718
Molar Refractivity: 109.0±0.4 cm3
#H bond acceptors: 10
#H bond donors: 7
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 0.09
ACD/LogD (pH 5.5): 0.44
ACD/BCF (pH 5.5): 1.27
ACD/KOC (pH 5.5): 41.24
ACD/LogD (pH 7.4): 0.43
ACD/BCF (pH 7.4): 1.25
ACD/KOC (pH 7.4): 40.83
Polar Surface Area: 233 Å2
Polarizability: 43.2±0.5 10-24cm3
Surface Tension: 87.9±3.0 dyne/cm
Molar Volume: 276.5±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement