ChemSpider 2D Image | N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-methylbutyl]-4-chloro-3-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide | C23H27ClN4O3S

N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-methylbutyl]-4-chloro-3-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide

  • Molecular FormulaC23H27ClN4O3S
  • Average mass475.004 Da
  • Monoisotopic mass474.149231 Da
  • ChemSpider ID32513716

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Benzamide, N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-4-chloro-3-(tetrahydro-1,1-dioxido-2H-1,2-thiazin-2-yl)- [ACD/Index Name]
N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-methylbutyl]-4-chlor-3-(1,1-dioxido-1,2-thiazinan-2-yl)benzamid [German] [ACD/IUPAC Name]
N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-methylbutyl]-4-chloro-3-(1,1-dioxido-1,2-thiazinan-2-yl)benzamide [ACD/IUPAC Name]
N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-méthylbutyl]-4-chloro-3-(1,1-dioxydo-1,2-thiazinan-2-yl)benzamide [French] [ACD/IUPAC Name]
1630917-80-4 [RN]
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylbutyl]-4-chloro-3-(1,1-dioxothiazinan-2-yl)benzamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.632
    Molar Refractivity: 126.3±0.4 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 4.01
    ACD/LogD (pH 5.5): 3.17
    ACD/BCF (pH 5.5): 136.04
    ACD/KOC (pH 5.5): 1028.83
    ACD/LogD (pH 7.4): 3.37
    ACD/BCF (pH 7.4): 213.47
    ACD/KOC (pH 7.4): 1614.44
    Polar Surface Area: 104 Å2
    Polarizability: 50.0±0.5 10-24cm3
    Surface Tension: 59.0±3.0 dyne/cm
    Molar Volume: 354.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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