ChemSpider 2D Image | N-[(2S)-1-(1-Azepanyl)-4-methyl-1-oxo-2-pentanyl]-1-[(4-methoxyphenyl)sulfonyl]-4-piperidinecarboxamide | C25H39N3O5S

N-[(2S)-1-(1-Azepanyl)-4-methyl-1-oxo-2-pentanyl]-1-[(4-methoxyphenyl)sulfonyl]-4-piperidinecarboxamide

  • Molecular FormulaC25H39N3O5S
  • Average mass493.659 Da
  • Monoisotopic mass493.261047 Da
  • ChemSpider ID22882793

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

4-Piperidinecarboxamide, N-[(1S)-1-[(hexahydro-1H-azepin-1-yl)carbonyl]-3-methylbutyl]-1-[(4-methoxyphenyl)sulfonyl]- [ACD/Index Name]
N-[(2S)-1-(1-Azepanyl)-4-methyl-1-oxo-2-pentanyl]-1-[(4-methoxyphenyl)sulfonyl]-4-piperidincarboxamid [German] [ACD/IUPAC Name]
N-[(2S)-1-(1-Azepanyl)-4-methyl-1-oxo-2-pentanyl]-1-[(4-methoxyphenyl)sulfonyl]-4-piperidinecarboxamide [ACD/IUPAC Name]
N-[(2S)-1-(1-Azépanyl)-4-méthyl-1-oxo-2-pentanyl]-1-[(4-méthoxyphényl)sulfonyl]-4-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1014403-87-2 [RN]
N-[(2S)-1-(azepan-1-yl)-4-methyl-1-oxopentan-2-yl]-1-(4-methoxyphenyl)sulfonylpiperidine-4-carboxamide
N-[(2S)-1-(azepan-1-yl)-4-methyl-1-oxopentan-2-yl]-1-[(4-methoxyphenyl)sulfonyl]piperidine-4-carboxamide

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

    Density: 1.2±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.550
    Molar Refractivity: 132.8±0.4 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 4.62
    ACD/LogD (pH 5.5): 3.84
    ACD/BCF (pH 5.5): 485.24
    ACD/KOC (pH 5.5): 2912.11
    ACD/LogD (pH 7.4): 3.84
    ACD/BCF (pH 7.4): 485.24
    ACD/KOC (pH 7.4): 2912.12
    Polar Surface Area: 104 Å2
    Polarizability: 52.6±0.5 10-24cm3
    Surface Tension: 46.5±3.0 dyne/cm
    Molar Volume: 417.1±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement