ChemSpider 2D Image | (2R)-N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(3-cyano-4,6-dimethyl-2-pyridinyl)sulfanyl]-2-phenylacetamide | C23H17ClF3N3OS

(2R)-N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(3-cyano-4,6-dimethyl-2-pyridinyl)sulfanyl]-2-phenylacetamide

  • Molecular FormulaC23H17ClF3N3OS
  • Average mass475.914 Da
  • Monoisotopic mass475.073303 Da
  • ChemSpider ID62309784

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-N-[2-Chlor-5-(trifluormethyl)phenyl]-2-[(3-cyan-4,6-dimethyl-2-pyridinyl)sulfanyl]-2-phenylacetamid [German] [ACD/IUPAC Name]
(2R)-N-[2-Chloro-5-(trifluoromethyl)phenyl]-2-[(3-cyano-4,6-dimethyl-2-pyridinyl)sulfanyl]-2-phenylacetamide [ACD/IUPAC Name]
(2R)-N-[2-Chloro-5-(trifluorométhyl)phényl]-2-[(3-cyano-4,6-diméthyl-2-pyridinyl)sulfanyl]-2-phénylacétamide [French] [ACD/IUPAC Name]
Benzeneacetamide, N-[2-chloro-5-(trifluoromethyl)phenyl]-α-[(3-cyano-4,6-dimethyl-2-pyridinyl)thio]-, (αR)- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 609.7±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.7 mmHg at 25°C
Enthalpy of Vaporization: 90.6±3.0 kJ/mol
Flash Point: 322.5±31.5 °C
Index of Refraction: 1.621
Molar Refractivity: 118.6±0.4 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 1
ACD/LogP: 5.61
ACD/LogD (pH 5.5): 5.97
ACD/BCF (pH 5.5): 20229.51
ACD/KOC (pH 5.5): 42054.24
ACD/LogD (pH 7.4): 5.97
ACD/BCF (pH 7.4): 20225.67
ACD/KOC (pH 7.4): 42046.25
Polar Surface Area: 91 Å2
Polarizability: 47.0±0.5 10-24cm3
Surface Tension: 58.8±5.0 dyne/cm
Molar Volume: 337.4±5.0 cm3

Click to predict properties on the Chemicalize site


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