Found 1848 results

Search term: MF = 'C_{21}H_{32}N_{4}O_{4}'
ChemSpider 2D Image | 2-({4-[2-(Dimethylamino)-2-oxoethyl]-1-piperazinyl}methyl)-4-[(2,6-dimethylphenyl)amino]-4-oxobutanoic acid | C21H32N4O4

2-({4-[2-(Dimethylamino)-2-oxoethyl]-1-piperazinyl}methyl)-4-[(2,6-dimethylphenyl)amino]-4-oxobutanoic acid

  • Molecular FormulaC21H32N4O4
  • Average mass404.503 Da
  • Monoisotopic mass404.242371 Da
  • ChemSpider ID27329228

More details:

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

1-Piperazinepropanoic acid, 4-[2-(dimethylamino)-2-oxoethyl]-α-[2-[(2,6-dimethylphenyl)amino]-2-oxoethyl]- [ACD/Index Name]
2-({4-[2-(Dimethylamino)-2-oxoethyl]-1-piperazinyl}methyl)-4-[(2,6-dimethylphenyl)amino]-4-oxobutanoic acid [ACD/IUPAC Name]
2-({4-[2-(Dimethylamino)-2-oxoethyl]-1-piperazinyl}methyl)-4-[(2,6-dimethylphenyl)amino]-4-oxobutansäure [German] [ACD/IUPAC Name]
Acide 2-({4-[2-(diméthylamino)-2-oxoéthyl]-1-pipérazinyl}méthyl)-4-[(2,6-diméthylphényl)amino]-4-oxobutanoïque [French] [ACD/IUPAC Name]
1282098-03-6 [RN]
2-({4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl}methyl)-4-[(2,6-dimethylphenyl)amino]-4-oxobutanoic acid
2-(4-Dimethylcarbamoylmethyl-piperazin-1-ylmethyl)-N-(2,6-dimethyl-phenyl)-succinamic acid
2-[[4-[2-(dimethylamino)-2-oxoethyl]piperazin-1-yl]methyl]-4-(2,6-dimethylanilino)-4-oxobutanoic acid

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 625.1±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.9 mmHg at 25°C
    Enthalpy of Vaporization: 97.3±3.0 kJ/mol
    Flash Point: 331.8±31.5 °C
    Index of Refraction: 1.572
    Molar Refractivity: 111.5±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 1.16
    ACD/LogD (pH 5.5): -1.31
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): -1.56
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 93 Å2
    Polarizability: 44.2±0.5 10-24cm3
    Surface Tension: 51.7±3.0 dyne/cm
    Molar Volume: 339.1±3.0 cm3

    Click to predict properties on the Chemicalize site


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