Found 1848 results

Search term: MF = 'C_{21}H_{32}N_{4}O_{4}'
ChemSpider 2D Image | 4-[(3-Hydroxyphenyl)amino]-4-oxo-2-({4-[2-(1-pyrrolidinyl)ethyl]-1-piperazinyl}methyl)butanoic acid | C21H32N4O4

4-[(3-Hydroxyphenyl)amino]-4-oxo-2-({4-[2-(1-pyrrolidinyl)ethyl]-1-piperazinyl}methyl)butanoic acid

  • Molecular FormulaC21H32N4O4
  • Average mass404.503 Da
  • Monoisotopic mass404.242371 Da
  • ChemSpider ID27322170

More details:

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

1-Piperazinepropanoic acid, α-[2-[(3-hydroxyphenyl)amino]-2-oxoethyl]-4-[2-(1-pyrrolidinyl)ethyl]- [ACD/Index Name]
4-[(3-Hydroxyphenyl)amino]-4-oxo-2-({4-[2-(1-pyrrolidinyl)ethyl]-1-piperazinyl}methyl)butanoic acid [ACD/IUPAC Name]
4-[(3-Hydroxyphenyl)amino]-4-oxo-2-({4-[2-(1-pyrrolidinyl)ethyl]-1-piperazinyl}methyl)butansäure [German] [ACD/IUPAC Name]
Acide 4-[(3-hydroxyphényl)amino]-4-oxo-2-({4-[2-(1-pyrrolidinyl)éthyl]-1-pipérazinyl}méthyl)butanoïque [French] [ACD/IUPAC Name]
1324061-60-0 [RN]
3-[(3-HYDROXYPHENYL)CARBAMOYL]-2-({4-[2-(PYRROLIDIN-1-YL)ETHYL]PIPERAZIN-1-YL}METHYL)PROPANOIC ACID
4-(3-hydroxyanilino)-4-oxo-2-[[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]methyl]butanoic acid
4-[(3-hydroxyphenyl)amino]-4-oxo-2-({4-[2-(pyrrolidin-1-yl)ethyl]piperazin-1-yl}methyl)butanoic acid
N-(3-Hydroxy-phenyl)-2-[4-(2-pyrrolidin-1-yl-ethyl)-piperazin-1-ylmethyl]-succinamic acid

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 659.0±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 101.9±3.0 kJ/mol
    Flash Point: 352.3±31.5 °C
    Index of Refraction: 1.601
    Molar Refractivity: 110.8±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 3
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 0
    ACD/LogP: 1.22
    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): -1.84
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 96 Å2
    Polarizability: 43.9±0.5 10-24cm3
    Surface Tension: 58.2±3.0 dyne/cm
    Molar Volume: 323.4±3.0 cm3

    Click to predict properties on the Chemicalize site


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