ChemSpider 2D Image | N-Benzyl-3-[(4-chlorophenyl)sulfonyl]-N-(4-ethoxy-1,3-benzothiazol-2-yl)propanamide | C25H23ClN2O4S2

N-Benzyl-3-[(4-chlorophenyl)sulfonyl]-N-(4-ethoxy-1,3-benzothiazol-2-yl)propanamide

  • Molecular FormulaC25H23ClN2O4S2
  • Average mass515.044 Da
  • Monoisotopic mass514.078796 Da
  • ChemSpider ID20837372

More details:

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

N-Benzyl-3-[(4-chlorophenyl)sulfonyl]-N-(4-ethoxy-1,3-benzothiazol-2-yl)propanamide [ACD/IUPAC Name]
N-Benzyl-3-[(4-chlorophényl)sulfonyl]-N-(4-éthoxy-1,3-benzothiazol-2-yl)propanamide [French] [ACD/IUPAC Name]
N-Benzyl-3-[(4-chlorphenyl)sulfonyl]-N-(4-ethoxy-1,3-benzothiazol-2-yl)propanamid [German] [ACD/IUPAC Name]
Propanamide, 3-[(4-chlorophenyl)sulfonyl]-N-(4-ethoxy-2-benzothiazolyl)-N-(phenylmethyl)- [ACD/Index Name]
N-benzyl-3-((4-chlorophenyl)sulfonyl)-N-(4-ethoxybenzo[d]thiazol-2-yl)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: 698.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 102.3±3.0 kJ/mol
Flash Point: 376.4±34.3 °C
Index of Refraction: 1.653
Molar Refractivity: 136.8±0.4 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 5.41
ACD/LogD (pH 5.5): 4.90
ACD/BCF (pH 5.5): 3128.56
ACD/KOC (pH 5.5): 11054.69
ACD/LogD (pH 7.4): 4.90
ACD/BCF (pH 7.4): 3128.97
ACD/KOC (pH 7.4): 11056.11
Polar Surface Area: 113 Å2
Polarizability: 54.2±0.5 10-24cm3
Surface Tension: 60.9±3.0 dyne/cm
Molar Volume: 373.7±3.0 cm3

Click to predict properties on the Chemicalize site


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