ChemSpider 2D Image | 2-[(2-Isopropyl-5-methylphenoxy)methyl]-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol | C30H28N4O4

2-[(2-Isopropyl-5-methylphenoxy)methyl]-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol

  • Molecular FormulaC30H28N4O4
  • Average mass508.568 Da
  • Monoisotopic mass508.211060 Da
  • ChemSpider ID2578986

More details:

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

12H-[1]Benzopyrano[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol, 12-(4-methoxyphenyl)-2-[[5-methyl-2-(1-methylethyl)phenoxy]methyl]- [ACD/Index Name]
2-[(2-Isopropyl-5-methylphenoxy)methyl]-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol [ACD/IUPAC Name]
2-[(2-Isopropyl-5-methylphenoxy)methyl]-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol [German] [ACD/IUPAC Name]
2-[(2-Isopropyl-5-méthylphénoxy)méthyl]-12-(4-méthoxyphényl)-12H-chroméno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol [French] [ACD/IUPAC Name]
12-(4-methoxyphenyl)-2-{[5-methyl-2-(propan-2-yl)phenoxy]methyl}-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
2-((2-isopropyl-5-methylphenoxy)methyl)-12-(4-methoxyphenyl)-12H-chromeno[3,2-e][1,2,4]triazolo[1,5-c]pyrimidin-9-ol
2-(2-Isopropyl-5-methyl-phenoxymethyl)-11-(4-methoxy-phenyl)-11H-6-oxa-1,3,3a,5-tetraaza-cyclopenta[a]anthracen-8-ol
842962-08-7 [RN]

    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: 1.671
    Molar Refractivity: 142.9±0.5 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 5.17
    ACD/LogD (pH 5.5): 5.78
    ACD/BCF (pH 5.5): 14461.42
    ACD/KOC (pH 5.5): 33061.45
    ACD/LogD (pH 7.4): 5.74
    ACD/BCF (pH 7.4): 13251.09
    ACD/KOC (pH 7.4): 30294.40
    Polar Surface Area: 91 Å2
    Polarizability: 56.7±0.5 10-24cm3
    Surface Tension: 49.0±7.0 dyne/cm
    Molar Volume: 381.9±7.0 cm3

    Click to predict properties on the Chemicalize site


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