ChemSpider 2D Image | 2-[(1,1-Dioxidotetrahydro-3-thiophenyl)sulfanyl]-N-[(1-phenylcyclobutyl)methyl]benzamide | C22H25NO3S2

2-[(1,1-Dioxidotetrahydro-3-thiophenyl)sulfanyl]-N-[(1-phenylcyclobutyl)methyl]benzamide

  • Molecular FormulaC22H25NO3S2
  • Average mass415.569 Da
  • Monoisotopic mass415.127594 Da
  • ChemSpider ID21733260

More details:

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

2-[(1,1-Dioxidotetrahydro-3-thiophenyl)sulfanyl]-N-[(1-phenylcyclobutyl)methyl]benzamid [German] [ACD/IUPAC Name]
2-[(1,1-Dioxidotetrahydro-3-thiophenyl)sulfanyl]-N-[(1-phenylcyclobutyl)methyl]benzamide [ACD/IUPAC Name]
2-[(1,1-Dioxydotétrahydro-3-thiophényl)sulfanyl]-N-[(1-phénylcyclobutyl)méthyl]benzamide [French] [ACD/IUPAC Name]
Benzamide, N-[(1-phenylcyclobutyl)methyl]-2-[(tetrahydro-1,1-dioxido-3-thienyl)thio]- [ACD/Index Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 670.1±50.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 98.5±3.0 kJ/mol
Flash Point: 359.0±30.1 °C
Index of Refraction: 1.648
Molar Refractivity: 114.3±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 2.85
ACD/LogD (pH 5.5): 2.98
ACD/BCF (pH 5.5): 108.15
ACD/KOC (pH 5.5): 994.40
ACD/LogD (pH 7.4): 2.98
ACD/BCF (pH 7.4): 108.15
ACD/KOC (pH 7.4): 994.40
Polar Surface Area: 97 Å2
Polarizability: 45.3±0.5 10-24cm3
Surface Tension: 60.8±5.0 dyne/cm
Molar Volume: 314.1±5.0 cm3

Click to predict properties on the Chemicalize site


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