ChemSpider 2D Image | (3R,3'S,5'S)-N-(5-Chloro-2-methoxyphenyl)-5-fluoro-5'-isobutyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide | C23H25ClFN3O3

(3R,3'S,5'S)-N-(5-Chloro-2-methoxyphenyl)-5-fluoro-5'-isobutyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide

  • Molecular FormulaC23H25ClFN3O3
  • Average mass445.914 Da
  • Monoisotopic mass445.156860 Da
  • ChemSpider ID22881715

  • defined stereocentres - 3 of 3 defined stereocentres

More details:

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

(3R,3'S,5'S)-N-(5-Chlor-2-methoxyphenyl)-5-fluor-5'-isobutyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamid [German] [ACD/IUPAC Name]
(3R,3'S,5'S)-N-(5-Chloro-2-methoxyphenyl)-5-fluoro-5'-isobutyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide [ACD/IUPAC Name]
(3R,3'S,5'S)-N-(5-Chloro-2-méthoxyphényl)-5-fluoro-5'-isobutyl-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide [French] [ACD/IUPAC Name]
Spiro[3H-indole-3,2'-pyrrolidine]-3'-carboxamide, N-(5-chloro-2-methoxyphenyl)-5-fluoro-1,2-dihydro-5'-(2-methylpropyl)-2-oxo-, (3R,3'S,5'S)- [ACD/Index Name]
(3R,3'S,5'S)-N-(5-chloro-2-methoxyphenyl)-5-fluoro-5'-(2-methylpropyl)-2-oxo-1,2-dihydrospiro[indole-3,2'-pyrrolidine]-3'-carboxamide
(3R,3'S,5'S)-N-(5-chloro-2-methoxyphenyl)-5-fluoro-5'-(2-methylpropyl)-2-oxospiro[1H-indole-3,2'-pyrrolidine]-3'-carboxamide
1014063-51-4 [RN]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 636.8±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 94.1±3.0 kJ/mol
    Flash Point: 338.9±31.5 °C
    Index of Refraction: 1.618
    Molar Refractivity: 116.1±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 3
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 1
    ACD/LogP: 5.10
    ACD/LogD (pH 5.5): 3.72
    ACD/BCF (pH 5.5): 289.66
    ACD/KOC (pH 5.5): 1382.35
    ACD/LogD (pH 7.4): 4.28
    ACD/BCF (pH 7.4): 1050.26
    ACD/KOC (pH 7.4): 5012.21
    Polar Surface Area: 79 Å2
    Polarizability: 46.0±0.5 10-24cm3
    Surface Tension: 55.9±5.0 dyne/cm
    Molar Volume: 331.3±5.0 cm3

    Click to predict properties on the Chemicalize site


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