ChemSpider 2D Image | 1-(4-{5-[1-(4-Morpholinylsulfonyl)-3-azetidinyl]-1,2,4-oxadiazol-3-yl}-1-piperidinyl)ethanone | C16H25N5O5S

1-(4-{5-[1-(4-Morpholinylsulfonyl)-3-azetidinyl]-1,2,4-oxadiazol-3-yl}-1-piperidinyl)ethanone

  • Molecular FormulaC16H25N5O5S
  • Average mass399.465 Da
  • Monoisotopic mass399.157654 Da
  • ChemSpider ID71072076

More details:






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

1-(4-{5-[1-(4-Morpholinylsulfonyl)-3-azetidinyl]-1,2,4-oxadiazol-3-yl}-1-piperidinyl)ethanon [German] [ACD/IUPAC Name]
1-(4-{5-[1-(4-Morpholinylsulfonyl)-3-azetidinyl]-1,2,4-oxadiazol-3-yl}-1-piperidinyl)ethanone [ACD/IUPAC Name]
1-(4-{5-[1-(4-Morpholinylsulfonyl)-3-azétidinyl]-1,2,4-oxadiazol-3-yl}-1-pipéridinyl)éthanone [French] [ACD/IUPAC Name]
Ethanone, 1-[4-[5-[1-(4-morpholinylsulfonyl)-3-azetidinyl]-1,2,4-oxadiazol-3-yl]-1-piperidinyl]- [ACD/Index Name]
1-(4-{5-[1-(morpholinosulfonyl)-3-azetanyl]-1,2,4-oxadiazol-3-yl}piperidino)-1-ethanone

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

Density: 1.5±0.1 g/cm3
Boiling Point: 647.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.4±3.0 kJ/mol
Flash Point: 345.2±34.3 °C
Index of Refraction: 1.619
Molar Refractivity: 95.8±0.4 cm3
#H bond acceptors: 10
#H bond donors: 0
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 1
ACD/LogP: -2.95
ACD/LogD (pH 5.5): -1.50
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.62
ACD/LogD (pH 7.4): -1.50
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 3.62
Polar Surface Area: 117 Å2
Polarizability: 38.0±0.5 10-24cm3
Surface Tension: 73.7±5.0 dyne/cm
Molar Volume: 273.3±5.0 cm3

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