ChemSpider 2D Image | {5-[(Dimethylamino)methyl]-1,3,4-oxadiazol-2-yl}[4-(ethylsulfonyl)-1-piperazinyl]methanone | C12H21N5O4S

{5-[(Dimethylamino)methyl]-1,3,4-oxadiazol-2-yl}[4-(ethylsulfonyl)-1-piperazinyl]methanone

  • Molecular FormulaC12H21N5O4S
  • Average mass331.391 Da
  • Monoisotopic mass331.131439 Da
  • ChemSpider ID29594058

More details:

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

{5-[(Dimethylamino)methyl]-1,3,4-oxadiazol-2-yl}[4-(ethylsulfonyl)-1-piperazinyl]methanon [German] [ACD/IUPAC Name]
{5-[(Dimethylamino)methyl]-1,3,4-oxadiazol-2-yl}[4-(ethylsulfonyl)-1-piperazinyl]methanone [ACD/IUPAC Name]
{5-[(Diméthylamino)méthyl]-1,3,4-oxadiazol-2-yl}[4-(éthylsulfonyl)-1-pipérazinyl]méthanone [French] [ACD/IUPAC Name]
Methanone, [5-[(dimethylamino)methyl]-1,3,4-oxadiazol-2-yl][4-(ethylsulfonyl)-1-piperazinyl]- [ACD/Index Name]
1-(5-{[4-(ethylsulfonyl)piperazin-1-yl]carbonyl}-1,3,4-oxadiazol-2-yl)-N,N-dimethylmethanamine

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

Density: 1.4±0.1 g/cm3
Boiling Point: 484.9±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 75.0±3.0 kJ/mol
Flash Point: 247.1±31.5 °C
Index of Refraction: 1.582
Molar Refractivity: 79.7±0.4 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 0
ACD/LogP: -1.15
ACD/LogD (pH 5.5): -2.03
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -1.15
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 5.43
Polar Surface Area: 108 Å2
Polarizability: 31.6±0.5 10-24cm3
Surface Tension: 67.0±5.0 dyne/cm
Molar Volume: 238.8±5.0 cm3

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