ChemSpider 2D Image | N-({5-[(2S)-1-(2-Methoxyethyl)-5-oxo-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}methyl)-1-methyl-1H-pyrazole-4-sulfonamide | C14H20N6O5S

N-({5-[(2S)-1-(2-Methoxyethyl)-5-oxo-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}methyl)-1-methyl-1H-pyrazole-4-sulfonamide

  • Molecular FormulaC14H20N6O5S
  • Average mass384.411 Da
  • Monoisotopic mass384.121582 Da
  • ChemSpider ID82825711

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1H-Pyrazole-4-sulfonamide, N-[[5-[(2S)-1-(2-methoxyethyl)-5-oxo-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl]methyl]-1-methyl- [ACD/Index Name]
N-({5-[(2S)-1-(2-Methoxyethyl)-5-oxo-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}methyl)-1-methyl-1H-pyrazol-4-sulfonamid [German] [ACD/IUPAC Name]
N-({5-[(2S)-1-(2-Methoxyethyl)-5-oxo-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}methyl)-1-methyl-1H-pyrazole-4-sulfonamide [ACD/IUPAC Name]
N-({5-[(2S)-1-(2-Méthoxyéthyl)-5-oxo-2-pyrrolidinyl]-1,2,4-oxadiazol-3-yl}méthyl)-1-méthyl-1H-pyrazole-4-sulfonamide [French] [ACD/IUPAC Name]

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

Density: 1.6±0.1 g/cm3
Boiling Point: 645.7±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 95.2±3.0 kJ/mol
Flash Point: 344.3±34.3 °C
Index of Refraction: 1.692
Molar Refractivity: 92.6±0.5 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -1.55
ACD/LogD (pH 5.5): -0.79
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 8.69
ACD/LogD (pH 7.4): -1.38
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 2.26
Polar Surface Area: 141 Å2
Polarizability: 36.7±0.5 10-24cm3
Surface Tension: 65.7±7.0 dyne/cm
Molar Volume: 241.7±7.0 cm3

Click to predict properties on the Chemicalize site


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