ChemSpider 2D Image | N-Cyclopropyl-4-[7-{[(cis-3-hydroxy-3-methylcyclobutyl)methyl]amino}-5-(3-pyridinyloxy)pyrazolo[1,5-a]pyrimidin-3-yl]-2-methylbenzamide | C28H30N6O3

N-Cyclopropyl-4-[7-{[(cis-3-hydroxy-3-methylcyclobutyl)methyl]amino}-5-(3-pyridinyloxy)pyrazolo[1,5-a]pyrimidin-3-yl]-2-methylbenzamide

  • Molecular FormulaC28H30N6O3
  • Average mass498.576 Da
  • Monoisotopic mass498.237946 Da
  • ChemSpider ID60600040

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Benzamide, N-cyclopropyl-4-[7-[[(cis-3-hydroxy-3-methylcyclobutyl)methyl]amino]-5-(3-pyridinyloxy)pyrazolo[1,5-a]pyrimidin-3-yl]-2-methyl- [ACD/Index Name]
N-Cyclopropyl-4-[7-{[(cis-3-hydroxy-3-methylcyclobutyl)methyl]amino}-5-(3-pyridinyloxy)pyrazolo[1,5-a]pyrimidin-3-yl]-2-methylbenzamid [German] [ACD/IUPAC Name]
N-Cyclopropyl-4-[7-{[(cis-3-hydroxy-3-methylcyclobutyl)methyl]amino}-5-(3-pyridinyloxy)pyrazolo[1,5-a]pyrimidin-3-yl]-2-methylbenzamide [ACD/IUPAC Name]
N-Cyclopropyl-4-[7-{[(cis-3-hydroxy-3-méthylcyclobutyl)méthyl]amino}-5-(3-pyridinyloxy)pyrazolo[1,5-a]pyrimidin-3-yl]-2-méthylbenzamide [French] [ACD/IUPAC Name]
1610677-37-6 [RN]
1610759-22-2 [RN]
CFI-402257
https://www.ebi.ac.uk/chembl/compoundreportcard/CHEMBL4469414/
N-cyclopropyl-4-[7-[(3-hydroxy-3-methylcyclobutyl)methylamino]-5-pyridin-3-yloxypyrazolo[1,5-a]pyrimidin-3-yl]-2-methylbenzamide
TTK

    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: 1.722
    Molar Refractivity: 138.8±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 3
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 3.03
    ACD/LogD (pH 5.5): 2.86
    ACD/BCF (pH 5.5): 87.14
    ACD/KOC (pH 5.5): 847.33
    ACD/LogD (pH 7.4): 2.87
    ACD/BCF (pH 7.4): 88.80
    ACD/KOC (pH 7.4): 863.47
    Polar Surface Area: 114 Å2
    Polarizability: 55.0±0.5 10-24cm3
    Surface Tension: 58.6±7.0 dyne/cm
    Molar Volume: 350.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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