ChemSpider 2D Image | 1-{1-[(1-Ethyl-1H-pyrazol-4-yl)sulfonyl]-3-azetidinyl}-N-(2-methoxyethyl)-5-oxo-3-pyrrolidinecarboxamide | C16H25N5O5S

1-{1-[(1-Ethyl-1H-pyrazol-4-yl)sulfonyl]-3-azetidinyl}-N-(2-methoxyethyl)-5-oxo-3-pyrrolidinecarboxamide

  • Molecular FormulaC16H25N5O5S
  • Average mass399.465 Da
  • Monoisotopic mass399.157654 Da
  • ChemSpider ID65151468

More details:






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

1-{1-[(1-Ethyl-1H-pyrazol-4-yl)sulfonyl]-3-azetidinyl}-N-(2-methoxyethyl)-5-oxo-3-pyrrolidincarboxamid [German] [ACD/IUPAC Name]
1-{1-[(1-Ethyl-1H-pyrazol-4-yl)sulfonyl]-3-azetidinyl}-N-(2-methoxyethyl)-5-oxo-3-pyrrolidinecarboxamide [ACD/IUPAC Name]
1-{1-[(1-Éthyl-1H-pyrazol-4-yl)sulfonyl]-3-azétidinyl}-N-(2-méthoxyéthyl)-5-oxo-3-pyrrolidinecarboxamide [French] [ACD/IUPAC Name]
3-Pyrrolidinecarboxamide, 1-[1-[(1-ethyl-1H-pyrazol-4-yl)sulfonyl]-3-azetidinyl]-N-(2-methoxyethyl)-5-oxo- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.668
Molar Refractivity: 99.1±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 1
ACD/LogP: -1.68
ACD/LogD (pH 5.5): -0.93
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 7.46
ACD/LogD (pH 7.4): -0.93
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.46
Polar Surface Area: 122 Å2
Polarizability: 39.3±0.5 10-24cm3
Surface Tension: 62.0±7.0 dyne/cm
Molar Volume: 266.0±7.0 cm3

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