ChemSpider 2D Image | 2-Chloro-5-[(6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-2-ylsulfanyl)acetyl]benzenesulfonamide | C17H14ClN3O5S2

2-Chloro-5-[(6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-2-ylsulfanyl)acetyl]benzenesulfonamide

  • Molecular FormulaC17H14ClN3O5S2
  • Average mass439.893 Da
  • Monoisotopic mass439.006348 Da
  • ChemSpider ID25058972

More details:






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

2-Chlor-5-[(6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-2-ylsulfanyl)acetyl]benzolsulfonamid [German] [ACD/IUPAC Name]
2-Chloro-5-[(6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-2-ylsulfanyl)acetyl]benzenesulfonamide [ACD/IUPAC Name]
2-Chloro-5-[2-(6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-2-ylsulfanyl)acétyl]benzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 2-chloro-5-[2-[(6,7-dihydro-1H-[1,4]dioxino[2,3-f]benzimidazol-2-yl)thio]acetyl]- [ACD/Index Name]

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.7±0.1 g/cm3
Boiling Point: 761.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.6 mmHg at 25°C
Enthalpy of Vaporization: 110.8±3.0 kJ/mol
Flash Point: 414.0±35.7 °C
Index of Refraction: 1.757
Molar Refractivity: 106.1±0.4 cm3
#H bond acceptors: 8
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: 2.65
ACD/LogD (pH 5.5): 2.36
ACD/BCF (pH 5.5): 35.26
ACD/KOC (pH 5.5): 430.05
ACD/LogD (pH 7.4): 2.38
ACD/BCF (pH 7.4): 37.59
ACD/KOC (pH 7.4): 458.52
Polar Surface Area: 158 Å2
Polarizability: 42.1±0.5 10-24cm3
Surface Tension: 96.0±5.0 dyne/cm
Molar Volume: 258.6±5.0 cm3

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