ChemSpider 2D Image | 5'-Chloro-N-{(3S)-1-[(2S)-1-(4-morpholinyl)-1-oxo-2-propanyl]-2-oxo-3-pyrrolidinyl}-2,2'-bithiophene-5-sulfonamide | C19H22ClN3O5S3

5'-Chloro-N-{(3S)-1-[(2S)-1-(4-morpholinyl)-1-oxo-2-propanyl]-2-oxo-3-pyrrolidinyl}-2,2'-bithiophene-5-sulfonamide

  • Molecular FormulaC19H22ClN3O5S3
  • Average mass504.043 Da
  • Monoisotopic mass503.041016 Da
  • ChemSpider ID8293540

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

[2,2'-Bithiophene]-5-sulfonamide, 5'-chloro-N-[(3S)-1-[(1S)-1-methyl-2-(4-morpholinyl)-2-oxoethyl]-2-oxo-3-pyrrolidinyl]- [ACD/Index Name]
5'-Chlor-N-{(3S)-1-[(2S)-1-(4-morpholinyl)-1-oxo-2-propanyl]-2-oxo-3-pyrrolidinyl}-2,2'-bithiophen-5-sulfonamid [German] [ACD/IUPAC Name]
5'-Chloro-N-{(3s)-1-[(1s)-1-Methyl-2-Morpholin-4-Yl-2-Oxoethyl]-2-Oxopyrrolidin-3-Yl}-2,2'-Bithiophene-5-Sulfonamide
5'-Chloro-N-{(3S)-1-[(2S)-1-(4-morpholinyl)-1-oxo-2-propanyl]-2-oxo-3-pyrrolidinyl}-2,2'-bithiophene-5-sulfonamide [ACD/IUPAC Name]
5'-Chloro-N-{(3S)-1-[(2S)-1-(4-morpholinyl)-1-oxo-2-propanyl]-2-oxo-3-pyrrolidinyl}-2,2'-bithiophène-5-sulfonamide [French] [ACD/IUPAC Name]
GSX
N-[(3S)-2-oxopyrrolidin-3-yl]sulfonamide, 1b

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

Density: 1.6±0.1 g/cm3
Boiling Point: 745.0±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.5 mmHg at 25°C
Enthalpy of Vaporization: 108.6±3.0 kJ/mol
Flash Point: 404.3±35.7 °C
Index of Refraction: 1.675
Molar Refractivity: 121.6±0.4 cm3
#H bond acceptors: 8
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 1
ACD/LogP: 2.24
ACD/LogD (pH 5.5): 1.94
ACD/BCF (pH 5.5): 17.43
ACD/KOC (pH 5.5): 269.19
ACD/LogD (pH 7.4): 1.93
ACD/BCF (pH 7.4): 17.16
ACD/KOC (pH 7.4): 265.01
Polar Surface Area: 161 Å2
Polarizability: 48.2±0.5 10-24cm3
Surface Tension: 74.9±5.0 dyne/cm
Molar Volume: 323.5±5.0 cm3

Click to predict properties on the Chemicalize site


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