ChemSpider 2D Image | 1-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(1,1-dioxidotetrahydro-3-thiophenyl)-N-propyl-3-piperidinecarboxamide | C18H29N3O6S2

1-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(1,1-dioxidotetrahydro-3-thiophenyl)-N-propyl-3-piperidinecarboxamide

  • Molecular FormulaC18H29N3O6S2
  • Average mass447.569 Da
  • Monoisotopic mass447.149780 Da
  • ChemSpider ID33095640

More details:

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

1-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(1,1-dioxidotetrahydro-3-thiophenyl)-N-propyl-3-piperidincarboxamid [German] [ACD/IUPAC Name]
1-[(3,5-Dimethyl-1,2-oxazol-4-yl)sulfonyl]-N-(1,1-dioxidotetrahydro-3-thiophenyl)-N-propyl-3-piperidinecarboxamide [ACD/IUPAC Name]
1-[(3,5-Diméthyl-1,2-oxazol-4-yl)sulfonyl]-N-(1,1-dioxydotétrahydro-3-thiophényl)-N-propyl-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
3-Piperidinecarboxamide, 1-[(3,5-dimethyl-4-isoxazolyl)sulfonyl]-N-propyl-N-(tetrahydro-1,1-dioxido-3-thienyl)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 699.0±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: 376.6±34.3 °C
Index of Refraction: 1.586
Molar Refractivity: 107.9±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: -0.17
ACD/LogD (pH 5.5): 0.54
ACD/BCF (pH 5.5): 1.51
ACD/KOC (pH 5.5): 46.77
ACD/LogD (pH 7.4): 0.54
ACD/BCF (pH 7.4): 1.51
ACD/KOC (pH 7.4): 46.77
Polar Surface Area: 135 Å2
Polarizability: 42.8±0.5 10-24cm3
Surface Tension: 63.0±5.0 dyne/cm
Molar Volume: 321.6±5.0 cm3

Click to predict properties on the Chemicalize site


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