Found 2 results

Search term: TXDKKEWSLZFYHQ (Found by InChIKey (skeleton match))
ChemSpider 2D Image | 4,4-Dichloro-N-{5-chloro-4-methyl-1-oxo-1-[(2S)-2-(1,3-thiazol-2-yl)-1-pyrrolidinyl]-2-pentanyl}-N,3-dimethylbutanamide | C19H28Cl3N3O2S

4,4-Dichloro-N-{5-chloro-4-methyl-1-oxo-1-[(2S)-2-(1,3-thiazol-2-yl)-1-pyrrolidinyl]-2-pentanyl}-N,3-dimethylbutanamide

  • Molecular FormulaC19H28Cl3N3O2S
  • Average mass468.868 Da
  • Monoisotopic mass467.096771 Da
  • ChemSpider ID29213011

  • defined stereocentres - 1 of 4 defined stereocentres

More details:

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

4,4-Dichlor-N-{5-chlor-4-methyl-1-oxo-1-[(2S)-2-(1,3-thiazol-2-yl)-1-pyrrolidinyl]-2-pentanyl}-N,3-dimethylbutanamid [German] [ACD/IUPAC Name]
4,4-Dichloro-N-{5-chloro-4-methyl-1-oxo-1-[(2S)-2-(1,3-thiazol-2-yl)-1-pyrrolidinyl]-2-pentanyl}-N,3-dimethylbutanamide [ACD/IUPAC Name]
4,4-Dichloro-N-{5-chloro-4-méthyl-1-oxo-1-[(2S)-2-(1,3-thiazol-2-yl)-1-pyrrolidinyl]-2-pentanyl}-N,3-diméthylbutanamide [French] [ACD/IUPAC Name]
Butanamide, 4,4-dichloro-N-[4-chloro-3-methyl-1-[[(2S)-2-(2-thiazolyl)-1-pyrrolidinyl]carbonyl]butyl]-N,3-dimethyl- [ACD/Index Name]
dysideaproline F

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

Density: 1.3±0.1 g/cm3
Boiling Point: 611.8±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 90.8±3.0 kJ/mol
Flash Point: 323.8±31.5 °C
Index of Refraction: 1.555
Molar Refractivity: 116.6±0.3 cm3
#H bond acceptors: 5
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 0
ACD/LogP: 3.29
ACD/LogD (pH 5.5): 3.82
ACD/BCF (pH 5.5): 473.25
ACD/KOC (pH 5.5): 2858.47
ACD/LogD (pH 7.4): 3.82
ACD/BCF (pH 7.4): 474.37
ACD/KOC (pH 7.4): 2865.26
Polar Surface Area: 82 Å2
Polarizability: 46.2±0.5 10-24cm3
Surface Tension: 50.0±3.0 dyne/cm
Molar Volume: 363.0±3.0 cm3

Click to predict properties on the Chemicalize site


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