ChemSpider 2D Image | N-[5-(4-Methoxybenzyl)-1H-1,2,4-triazol-3-yl]-1-(2-pyrimidinyl)-3-piperidinecarboxamide | C20H23N7O2

N-[5-(4-Methoxybenzyl)-1H-1,2,4-triazol-3-yl]-1-(2-pyrimidinyl)-3-piperidinecarboxamide

  • Molecular FormulaC20H23N7O2
  • Average mass393.442 Da
  • Monoisotopic mass393.191315 Da
  • ChemSpider ID32515335

More details:

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

3-Piperidinecarboxamide, N-[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]-1-(2-pyrimidinyl)- [ACD/Index Name]
N-[5-(4-Methoxybenzyl)-1H-1,2,4-triazol-3-yl]-1-(2-pyrimidinyl)-3-piperidincarboxamid [German] [ACD/IUPAC Name]
N-[5-(4-Methoxybenzyl)-1H-1,2,4-triazol-3-yl]-1-(2-pyrimidinyl)-3-piperidinecarboxamide [ACD/IUPAC Name]
N-[5-(4-Méthoxybenzyl)-1H-1,2,4-triazol-3-yl]-1-(2-pyrimidinyl)-3-pipéridinecarboxamide [French] [ACD/IUPAC Name]
1630900-04-7 [RN]
1-Pyrimidin-2-yl-piperidine-3-carboxylic acid [5-(4-methoxy-benzyl)-1H-[1,2,4]triazol-3-yl]-amide
N-[3-(4-methoxybenzyl)-1H-1,2,4-triazol-5-yl]-1-(pyrimidin-2-yl)piperidine-3-carboxamide
N-[5-[(4-methoxyphenyl)methyl]-1H-1,2,4-triazol-3-yl]-1-pyrimidin-2-ylpiperidine-3-carboxamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point:
    Vapour Pressure:
    Enthalpy of Vaporization:
    Flash Point:
    Index of Refraction: 1.650
    Molar Refractivity: 107.6±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 0
    ACD/LogP: 2.04
    ACD/LogD (pH 5.5): 1.99
    ACD/BCF (pH 5.5): 17.97
    ACD/KOC (pH 5.5): 252.49
    ACD/LogD (pH 7.4): 2.12
    ACD/BCF (pH 7.4): 24.16
    ACD/KOC (pH 7.4): 339.43
    Polar Surface Area: 109 Å2
    Polarizability: 42.7±0.5 10-24cm3
    Surface Tension: 72.5±3.0 dyne/cm
    Molar Volume: 294.9±3.0 cm3

    Click to predict properties on the Chemicalize site


    Advertisement