ChemSpider 2D Image | (2E)-N-(2-Chlorophenyl)-3-[2-(2-fluorophenyl)ethyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide | C25H20ClF2N3O2S

(2E)-N-(2-Chlorophenyl)-3-[2-(2-fluorophenyl)ethyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide

  • Molecular FormulaC25H20ClF2N3O2S
  • Average mass499.960 Da
  • Monoisotopic mass499.093292 Da
  • ChemSpider ID22914477

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-N-(2-Chlorophenyl)-3-[2-(2-fluorophenyl)ethyl]-2-[(4-fluorophenyl)imino]-4-oxo-1,3-thiazinane-6-carboxamide [ACD/IUPAC Name]
(2E)-N-(2-Chlorophényl)-3-[2-(2-fluorophényl)éthyl]-2-[(4-fluorophényl)imino]-4-oxo-1,3-thiazinane-6-carboxamide [French] [ACD/IUPAC Name]
(2E)-N-(2-Chlorphenyl)-3-[2-(2-fluorphenyl)ethyl]-2-[(4-fluorphenyl)imino]-4-oxo-1,3-thiazinan-6-carboxamid [German] [ACD/IUPAC Name]
2H-1,3-Thiazine-6-carboxamide, N-(2-chlorophenyl)-3-[2-(2-fluorophenyl)ethyl]-2-[(4-fluorophenyl)imino]tetrahydro-4-oxo-, (2E)- [ACD/Index Name]
3-[2-(2-Fluoro-phenyl)-ethyl]-2-(4-fluoro-phenylimino)-4-oxo-[1,3]thiazinane-6-carboxylic acid (2-chloro-phenyl)-amide
N-(2-chlorophenyl){2-[(4-fluorophenyl)azamethylene]-3-[2-(2-fluorophenyl)ethyl]-4-oxo(1,3-thiazaperhydroin-6-yl)}carboxamide

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

Density: 1.4±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.640
Molar Refractivity: 131.5±0.5 cm3
#H bond acceptors: 5
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 4.58
ACD/LogD (pH 5.5): 4.79
ACD/BCF (pH 5.5): 2581.13
ACD/KOC (pH 5.5): 9633.16
ACD/LogD (pH 7.4): 4.79
ACD/BCF (pH 7.4): 2581.03
ACD/KOC (pH 7.4): 9632.81
Polar Surface Area: 87 Å2
Polarizability: 52.1±0.5 10-24cm3
Surface Tension: 48.7±7.0 dyne/cm
Molar Volume: 364.9±7.0 cm3

Click to predict properties on the Chemicalize site


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