ChemSpider 2D Image | N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetamide | C21H23N7O2S

N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetamide

  • Molecular FormulaC21H23N7O2S
  • Average mass437.518 Da
  • Monoisotopic mass437.163391 Da
  • ChemSpider ID30720010

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acetamide, N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]- [ACD/Index Name]
N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetamid [German] [ACD/IUPAC Name]
N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-(methylsulfanyl)propyl]-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetamide [ACD/IUPAC Name]
N-[(1S)-1-(1H-Benzimidazol-2-yl)-3-(méthylsulfanyl)propyl]-2-[4-(2-méthyl-2H-tétrazol-5-yl)phénoxy]acétamide [French] [ACD/IUPAC Name]
(S)-N-(1-(1H-benzo[d]imidazol-2-yl)-3-(methylthio)propyl)-2-(4-(2-methyl-2H-tetrazol-5-yl)phenoxy)acetamide
1574350-79-0 [RN]
MolPort-029-883-931
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-(methylthio)propyl]-2-[4-(2-methyl-2H-tetrazol-5-yl)phenoxy]acetamide
N-[(1S)-1-(1H-benzimidazol-2-yl)-3-methylsulfanylpropyl]-2-[4-(2-methyltetrazol-5-yl)phenoxy]acetamide

    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: 1.704
    Molar Refractivity: 121.1±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 3.19
    ACD/LogD (pH 5.5): 2.25
    ACD/BCF (pH 5.5): 27.74
    ACD/KOC (pH 5.5): 342.62
    ACD/LogD (pH 7.4): 2.38
    ACD/BCF (pH 7.4): 38.08
    ACD/KOC (pH 7.4): 470.37
    Polar Surface Area: 136 Å2
    Polarizability: 48.0±0.5 10-24cm3
    Surface Tension: 57.2±7.0 dyne/cm
    Molar Volume: 311.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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