ChemSpider 2D Image | 3-{[4-(4-Chlorophenyl)-3-(methoxymethyl)-1H-pyrazol-5-yl]carbamoyl}-2-pyrazinecarboxylic acid | C17H14ClN5O4

3-{[4-(4-Chlorophenyl)-3-(methoxymethyl)-1H-pyrazol-5-yl]carbamoyl}-2-pyrazinecarboxylic acid

  • Molecular FormulaC17H14ClN5O4
  • Average mass387.777 Da
  • Monoisotopic mass387.073425 Da
  • ChemSpider ID30671787

More details:

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

2-Pyrazinecarboxylic acid, 3-[[[4-(4-chlorophenyl)-3-(methoxymethyl)-1H-pyrazol-5-yl]amino]carbonyl]- [ACD/Index Name]
3-{[4-(4-Chlorophenyl)-3-(methoxymethyl)-1H-pyrazol-5-yl]carbamoyl}-2-pyrazinecarboxylic acid [ACD/IUPAC Name]
3-{[4-(4-Chlorphenyl)-3-(methoxymethyl)-1H-pyrazol-5-yl]carbamoyl}-2-pyrazincarbonsäure [German] [ACD/IUPAC Name]
Acide 3-{[4-(4-chlorophényl)-3-(méthoxyméthyl)-1H-pyrazol-5-yl]carbamoyl}-2-pyrazinecarboxylique [French] [ACD/IUPAC Name]
1491130-66-5 [RN]
3-[[4-(4-chlorophenyl)-5-(methoxymethyl)-1H-pyrazol-3-yl]carbamoyl]pyrazine-2-carboxylic acid
3-{[4-(4-CHLOROPHENYL)-3-(METHOXYMETHYL)-1H-PYRAZOL-5-YL]CARBAMOYL}PYRAZINE-2-CARBOXYLIC ACID
3-{[4-(4-chlorophenyl)-5-(methoxymethyl)-1H-pyrazol-3-yl]carbamoyl}pyrazine-2-carboxylic acid
3-{[4-(4-CHLOROPHENYL)-5-(METHOXYMETHYL)-2H-PYRAZOL-3-YL]CARBAMOYL}PYRAZINE-2-CARBOXYLIC ACID
MCULE-1527726197
More...

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

    Density: 1.5±0.1 g/cm3
    Boiling Point: 599.2±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.8 mmHg at 25°C
    Enthalpy of Vaporization: 93.8±3.0 kJ/mol
    Flash Point: 316.2±30.1 °C
    Index of Refraction: 1.687
    Molar Refractivity: 97.2±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 3
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 0.55
    ACD/LogD (pH 5.5): -1.09
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.39
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 130 Å2
    Polarizability: 38.6±0.5 10-24cm3
    Surface Tension: 77.2±3.0 dyne/cm
    Molar Volume: 255.2±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement