ChemSpider 2D Image | N-{2-[(5-Benzyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}-4-(2-pyridinyl)-1-piperazinecarboxamide | C21H23N7O2S

N-{2-[(5-Benzyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}-4-(2-pyridinyl)-1-piperazinecarboxamide

  • Molecular FormulaC21H23N7O2S
  • Average mass437.518 Da
  • Monoisotopic mass437.163391 Da
  • ChemSpider ID27329432

More details:

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

1-Piperazinecarboxamide, N-[2-oxo-2-[[5-(phenylmethyl)-1,3,4-thiadiazol-2-yl]amino]ethyl]-4-(2-pyridinyl)- [ACD/Index Name]
N-{2-[(5-Benzyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}-4-(2-pyridinyl)-1-piperazincarboxamid [German] [ACD/IUPAC Name]
N-{2-[(5-Benzyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl}-4-(2-pyridinyl)-1-piperazinecarboxamide [ACD/IUPAC Name]
N-{2-[(5-Benzyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoéthyl}-4-(2-pyridinyl)-1-pipérazinecarboxamide [French] [ACD/IUPAC Name]
1246047-75-5 [RN]
4-Pyridin-2-yl-piperazine-1-carboxylic acid [(5-benzyl-[1,3,4]thiadiazol-2-ylcarbamoyl)-methyl]-amide
N-(2-{[(2Z)-5-benzyl-1,3,4-thiadiazol-2(3H)-ylidene]amino}-2-oxoethyl)-4-(pyridin-2-yl)piperazine-1-carboxamide
N-[2-[(5-benzyl-1,3,4-thiadiazol-2-yl)amino]-2-oxoethyl]-4-pyridin-2-ylpiperazine-1-carboxamide

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

    Density: 1.4±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.714
    Molar Refractivity: 121.8±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 1.12
    ACD/LogD (pH 5.5): -0.82
    ACD/BCF (pH 5.5): 1.00
    ACD/KOC (pH 5.5): 1.00
    ACD/LogD (pH 7.4): 0.53
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 16.29
    Polar Surface Area: 128 Å2
    Polarizability: 48.3±0.5 10-24cm3
    Surface Tension: 62.7±7.0 dyne/cm
    Molar Volume: 310.5±7.0 cm3

    Click to predict properties on the Chemicalize site


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