ChemSpider 2D Image | 3-{[(5-Cyclobutyl-1,2,4-oxadiazol-3-yl)methyl](methyl)amino}-N,N-dimethyl-1-propanesulfonamide | C13H24N4O3S

3-{[(5-Cyclobutyl-1,2,4-oxadiazol-3-yl)methyl](methyl)amino}-N,N-dimethyl-1-propanesulfonamide

  • Molecular FormulaC13H24N4O3S
  • Average mass316.420 Da
  • Monoisotopic mass316.156921 Da
  • ChemSpider ID35075570

More details:






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

1-Propanesulfonamide, 3-[[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl]methylamino]-N,N-dimethyl- [ACD/Index Name]
3-{[(5-Cyclobutyl-1,2,4-oxadiazol-3-yl)methyl](methyl)amino}-N,N-dimethyl-1-propanesulfonamide [ACD/IUPAC Name]
3-{[(5-Cyclobutyl-1,2,4-oxadiazol-3-yl)méthyl](méthyl)amino}-N,N-diméthyl-1-propanesulfonamide [French] [ACD/IUPAC Name]
3-{[(5-Cyclobutyl-1,2,4-oxadiazol-3-yl)methyl](methyl)amino}-N,N-dimethyl-1-propansulfonamid [German] [ACD/IUPAC Name]
3-[[(5-cyclobutyl-1,2,4-oxadiazol-3-yl)methyl](methyl)amino]-N,N-dimethylpropane-1-sulfonamide

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

Density: 1.2±0.1 g/cm3
Boiling Point: 459.2±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.1 mmHg at 25°C
Enthalpy of Vaporization: 72.0±3.0 kJ/mol
Flash Point: 231.5±31.5 °C
Index of Refraction: 1.541
Molar Refractivity: 80.3±0.4 cm3
#H bond acceptors: 7
#H bond donors: 0
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 0
ACD/LogP: 0.82
ACD/LogD (pH 5.5): 0.49
ACD/BCF (pH 5.5): 1.07
ACD/KOC (pH 5.5): 26.59
ACD/LogD (pH 7.4): 0.97
ACD/BCF (pH 7.4): 3.18
ACD/KOC (pH 7.4): 79.09
Polar Surface Area: 88 Å2
Polarizability: 31.8±0.5 10-24cm3
Surface Tension: 52.1±3.0 dyne/cm
Molar Volume: 255.3±3.0 cm3

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