ChemSpider 2D Image | 3,5-Dinitro-N-(4-oxo-4-{[4-(2-thienyl)-1,3-thiazol-2-yl]amino}butyl)benzamide | C18H15N5O6S2

3,5-Dinitro-N-(4-oxo-4-{[4-(2-thienyl)-1,3-thiazol-2-yl]amino}butyl)benzamide

  • Molecular FormulaC18H15N5O6S2
  • Average mass461.472 Da
  • Monoisotopic mass461.046387 Da
  • ChemSpider ID60213352

More details:

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

3,5-Dinitro-N-(4-oxo-4-{[4-(2-thienyl)-1,3-thiazol-2-yl]amino}butyl)benzamid [German] [ACD/IUPAC Name]
3,5-Dinitro-N-(4-oxo-4-{[4-(2-thienyl)-1,3-thiazol-2-yl]amino}butyl)benzamide [ACD/IUPAC Name]
3,5-Dinitro-N-(4-oxo-4-{[4-(2-thiényl)-1,3-thiazol-2-yl]amino}butyl)benzamide [French] [ACD/IUPAC Name]
Benzamide, 3,5-dinitro-N-[4-oxo-4-[[4-(2-thienyl)-2-thiazolyl]amino]butyl]- [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: 1.692
Molar Refractivity: 115.5±0.3 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 1
ACD/LogP: 3.25
ACD/LogD (pH 5.5): 2.96
ACD/BCF (pH 5.5): 105.42
ACD/KOC (pH 5.5): 976.30
ACD/LogD (pH 7.4): 2.96
ACD/BCF (pH 7.4): 103.91
ACD/KOC (pH 7.4): 962.31
Polar Surface Area: 219 Å2
Polarizability: 45.8±0.5 10-24cm3
Surface Tension: 73.9±3.0 dyne/cm
Molar Volume: 301.4±3.0 cm3

Click to predict properties on the Chemicalize site


Advertisement