ChemSpider 2D Image | 5-Chloro-N-[(2S)-2-({[2-chloro-5-fluoro-3-(2-oxo-1-piperidinyl)phenyl]sulfonyl}amino)-3-(4-methyl-1-piperazinyl)-3-oxopropyl]-2-thiophenecarboxamide | C24H28Cl2FN5O5S2

5-Chloro-N-[(2S)-2-({[2-chloro-5-fluoro-3-(2-oxo-1-piperidinyl)phenyl]sulfonyl}amino)-3-(4-methyl-1-piperazinyl)-3-oxopropyl]-2-thiophenecarboxamide

  • Molecular FormulaC24H28Cl2FN5O5S2
  • Average mass620.544 Da
  • Monoisotopic mass619.089294 Da
  • ChemSpider ID31129832

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-Thiophenecarboxamide, 5-chloro-N-[(2S)-2-[[[2-chloro-5-fluoro-3-(2-oxo-1-piperidinyl)phenyl]sulfonyl]amino]-3-(4-methyl-1-piperazinyl)-3-oxopropyl]- [ACD/Index Name]
5-Chlor-N-[(2S)-2-({[2-chlor-5-fluor-3-(2-oxo-1-piperidinyl)phenyl]sulfonyl}amino)-3-(4-methyl-1-piperazinyl)-3-oxopropyl]-2-thiophencarboxamid [German] [ACD/IUPAC Name]
5-Chloro-N-[(2S)-2-({[2-chloro-5-fluoro-3-(2-oxo-1-piperidinyl)phenyl]sulfonyl}amino)-3-(4-methyl-1-piperazinyl)-3-oxopropyl]-2-thiophenecarboxamide [ACD/IUPAC Name]
5-Chloro-N-[(2S)-2-({[2-chloro-5-fluoro-3-(2-oxo-1-pipéridinyl)phényl]sulfonyl}amino)-3-(4-méthyl-1-pipérazinyl)-3-oxopropyl]-2-thiophènecarboxamide [French] [ACD/IUPAC Name]
5-Chloro-Thiophene-2-Carboxylic Acid [(S)-2-[2-Chloro-5-Fluoro-3-(2-Oxo-Piperidin-1-Yl)-Benzenesulfonylamino]-3-(4-Methyl-Piperazin-1-Yl)-3-Oxo-Propyl]-Amide
6XS

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: 1.618
Molar Refractivity: 148.2±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 3.44
ACD/LogD (pH 5.5): 1.23
ACD/BCF (pH 5.5): 2.47
ACD/KOC (pH 5.5): 28.62
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 26.87
ACD/KOC (pH 7.4): 310.79
Polar Surface Area: 156 Å2
Polarizability: 58.8±0.5 10-24cm3
Surface Tension: 59.2±3.0 dyne/cm
Molar Volume: 422.8±3.0 cm3

Click to predict properties on the Chemicalize site


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