ChemSpider 2D Image | 3-[(3-Phenyl-1H-1,2,4-triazol-5-yl)carbamoyl]-2-pyrazinecarboxylic acid | C14H10N6O3

3-[(3-Phenyl-1H-1,2,4-triazol-5-yl)carbamoyl]-2-pyrazinecarboxylic acid

  • Molecular FormulaC14H10N6O3
  • Average mass310.268 Da
  • Monoisotopic mass310.081451 Da
  • ChemSpider ID30671378

More details:

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

2-Pyrazinecarboxylic acid, 3-[[(5-phenyl-4H-1,2,4-triazol-3-yl)amino]carbonyl]- [ACD/Index Name]
3-[(3-Phenyl-1H-1,2,4-triazol-5-yl)carbamoyl]-2-pyrazincarbonsäure [German] [ACD/IUPAC Name]
3-[(3-Phenyl-1H-1,2,4-triazol-5-yl)carbamoyl]-2-pyrazinecarboxylic acid [ACD/IUPAC Name]
Acide 3-[(3-phényl-1H-1,2,4-triazol-5-yl)carbamoyl]-2-pyrazinecarboxylique [French] [ACD/IUPAC Name]
1351690-91-9 [RN]
3-[(5-phenyl-1H-1,2,4-triazol-3-yl)carbamoyl]pyrazine-2-carboxylic acid
3-[(5-phenyl-4H-1,2,4-triazol-3-yl)carbamoyl]pyrazine-2-carboxylic acid

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

    Density: 1.6±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.735
    Molar Refractivity: 79.1±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 3
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: -0.40
    ACD/LogD (pH 5.5): -2.54
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -2.77
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 134 Å2
    Polarizability: 31.4±0.5 10-24cm3
    Surface Tension: 96.5±3.0 dyne/cm
    Molar Volume: 197.3±3.0 cm3

    Click to predict properties on the Chemicalize site


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