ChemSpider 2D Image | 1-Benzyl-5-({[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}amino)-1H-1,2,3-triazole-4-carboxamide | C16H17N7O2S

1-Benzyl-5-({[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}amino)-1H-1,2,3-triazole-4-carboxamide

  • Molecular FormulaC16H17N7O2S
  • Average mass371.417 Da
  • Monoisotopic mass371.116455 Da
  • ChemSpider ID23345212

More details:

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

1-Benzyl-5-({[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}amino)-1H-1,2,3-triazol-4-carboxamid [German] [ACD/IUPAC Name]
1-Benzyl-5-({[(1-methyl-1H-imidazol-2-yl)sulfanyl]acetyl}amino)-1H-1,2,3-triazole-4-carboxamide [ACD/IUPAC Name]
1-Benzyl-5-({2-[(1-méthyl-1H-imidazol-2-yl)sulfanyl]acétyl}amino)-1H-1,2,3-triazole-4-carboxamide [French] [ACD/IUPAC Name]
1H-1,2,3-Triazole-4-carboxamide, 5-[[2-[(1-methyl-1H-imidazol-2-yl)thio]acetyl]amino]-1-(phenylmethyl)- [ACD/Index Name]
1133126-81-4 [RN]
1-benzyl-5-({[(1-methyl-1H-imidazol-2-yl)thio]acetyl}amino)-1H-1,2,3-triazole-4-carboxamide
1-benzyl-5-[[2-(1-methylimidazol-2-yl)sulfanylacetyl]amino]triazole-4-carboxamide
AGN-PC-072RZ5
AO-476/43417657
MCULE-4469018471
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.732
    Molar Refractivity: 100.0±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 3
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 0
    ACD/LogP: 0.50
    ACD/LogD (pH 5.5): 0.65
    ACD/BCF (pH 5.5): 1.77
    ACD/KOC (pH 5.5): 49.64
    ACD/LogD (pH 7.4): 0.73
    ACD/BCF (pH 7.4): 2.12
    ACD/KOC (pH 7.4): 59.50
    Polar Surface Area: 146 Å2
    Polarizability: 39.6±0.5 10-24cm3
    Surface Tension: 67.1±7.0 dyne/cm
    Molar Volume: 250.0±7.0 cm3

    Click to predict properties on the Chemicalize site


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