ChemSpider 2D Image | 4-[(3-Chloro-4-methoxybenzyl)amino]-2-{2-[hydroxy(~13~C)methyl](~13~C_4_,~15~N)-1-pyrrolidinyl}-N-(2-pyrimidinylmethyl)-5-pyrimidinecarboxamide | C1813C5H26ClN615NO3

4-[(3-Chloro-4-methoxybenzyl)amino]-2-{2-[hydroxy(13C)methyl](13C4,15N)-1-pyrrolidinyl}-N-(2-pyrimidinylmethyl)-5-pyrimidinecarboxamide

  • Molecular FormulaC1813C5H26ClN615NO3
  • Average mass489.907 Da
  • Monoisotopic mass489.192383 Da
  • ChemSpider ID48059552

  • Non-standard isotope - Non-standard isotope

More details:

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

4-[(3-Chlor-4-methoxybenzyl)amino]-2-{2-[hydroxy(13C)methyl](13C4,15N)-1-pyrrolidinyl}-N-(2-pyrimidinylmethyl)-5-pyrimidincarboxamid [German] [ACD/IUPAC Name]
4-[(3-Chloro-4-methoxybenzyl)amino]-2-{2-[hydroxy(13C)methyl](13C4,15N)-1-pyrrolidinyl}-N-(2-pyrimidinylmethyl)-5-pyrimidinecarboxamide [ACD/IUPAC Name]
4-[(3-Chloro-4-méthoxybenzyl)amino]-2-{2-[hydroxy(13C)méthyl](13C4,15N)-1-pyrrolidinyl}-N-(2-pyrimidinylméthyl)-5-pyrimidinecarboxamide [French] [ACD/IUPAC Name]
5-Pyrimidinecarboxamide, 4-[[(3-chloro-4-methoxyphenyl)methyl]amino]-2-[2-(hydroxymethyl-13C)-1-pyrrolidinyl-2,3,4,5-13C4-1-15N]-N-(2-pyrimidinylmethyl)- [ACD/Index Name]
1276495-36-3 [RN]
4-[(3-chloro-4-methoxyphenyl)methylamino]-2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(pyrimidin-2-ylmethyl)pyrimidine-5-carboxamide
avanafil-13c5,15n

    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: 1.651
    Molar Refractivity: 128.8±0.3 cm3
    #H bond acceptors:
    #H bond donors:
    #Freely Rotating Bonds:
    #Rule of 5 Violations:
    ACD/LogP:
    ACD/LogD (pH 5.5):
    ACD/BCF (pH 5.5):
    ACD/KOC (pH 5.5):
    ACD/LogD (pH 7.4):
    ACD/BCF (pH 7.4):
    ACD/KOC (pH 7.4):
    Polar Surface Area:
    Polarizability: 51.1±0.5 10-24cm3
    Surface Tension: 70.0±3.0 dyne/cm
    Molar Volume: 352.6±3.0 cm3

    Click to predict properties on the Chemicalize site


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