Found 931 results

Search term: MF = 'C_{22}H_{28}ClN_{5}O_{2}'
ChemSpider 2D Image | 4-(4-Chlorophenyl)-N-{(2S)-3-methyl-1-oxo-1-[(3-pyridinylmethyl)amino]-2-butanyl}-1-piperazinecarboxamide | C22H28ClN5O2

4-(4-Chlorophenyl)-N-{(2S)-3-methyl-1-oxo-1-[(3-pyridinylmethyl)amino]-2-butanyl}-1-piperazinecarboxamide

  • Molecular FormulaC22H28ClN5O2
  • Average mass429.943 Da
  • Monoisotopic mass429.193146 Da
  • ChemSpider ID32036765

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-Piperazinecarboxamide, 4-(4-chlorophenyl)-N-[(1S)-2-methyl-1-[[(3-pyridinylmethyl)amino]carbonyl]propyl]- [ACD/Index Name]
4-(4-Chlorophenyl)-N-{(2S)-3-methyl-1-oxo-1-[(3-pyridinylmethyl)amino]-2-butanyl}-1-piperazinecarboxamide [ACD/IUPAC Name]
4-(4-Chlorophényl)-N-{(2S)-3-méthyl-1-oxo-1-[(3-pyridinylméthyl)amino]-2-butanyl}-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]
4-(4-Chlorphenyl)-N-{(2S)-3-methyl-1-oxo-1-[(3-pyridinylmethyl)amino]-2-butanyl}-1-piperazincarboxamid [German] [ACD/IUPAC Name]
(2S)-2-[4-(4-CHLOROPHENYL)PIPERAZINE-1-CARBONYLAMINO]-3-METHYL-N-(PYRIDIN-3-YLMETHYL)BUTANAMIDE
(2S)-2-{[4-(4-CHLOROPHENYL)PIPERAZINE-1-CARBONYL]AMINO}-3-METHYL-N-[(PYRIDIN-3-YL)METHYL]BUTANAMIDE
1401617-73-9 [RN]
4-(4-chlorophenyl)-N-[(2S)-3-methyl-1-oxo-1-(pyridin-3-ylmethylamino)butan-2-yl]piperazine-1-carboxamide
4-(4-Chloro-phenyl)-piperazine-1-carboxylic acid {2-methyl-1-[(pyridin-3-ylmethyl)-carbamoyl]-propyl}-amide

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 732.1±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.4 mmHg at 25°C
    Enthalpy of Vaporization: 106.8±3.0 kJ/mol
    Flash Point: 396.5±32.9 °C
    Index of Refraction: 1.587
    Molar Refractivity: 117.0±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.22
    ACD/LogD (pH 5.5): 2.54
    ACD/BCF (pH 5.5): 48.60
    ACD/KOC (pH 5.5): 543.44
    ACD/LogD (pH 7.4): 2.59
    ACD/BCF (pH 7.4): 54.26
    ACD/KOC (pH 7.4): 606.68
    Polar Surface Area: 78 Å2
    Polarizability: 46.4±0.5 10-24cm3
    Surface Tension: 52.6±3.0 dyne/cm
    Molar Volume: 347.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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