ChemSpider 2D Image | N-(3-Methoxyphenyl)-1,4-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide | C32H31N3O4

N-(3-Methoxyphenyl)-1,4-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide

  • Molecular FormulaC32H31N3O4
  • Average mass521.606 Da
  • Monoisotopic mass521.231445 Da
  • ChemSpider ID2934831

More details:

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

2a,4a-Diazacyclopent[cd]azulene-2-carboxamide, 5,6,7,8-tetrahydro-N-(3-methoxyphenyl)-1,4-bis(4-methoxyphenyl)- [ACD/Index Name]
N-(3-Methoxyphenyl)-1,4-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulen-2-carboxamid [German] [ACD/IUPAC Name]
N-(3-Methoxyphenyl)-1,4-bis(4-methoxyphenyl)-5,6,7,8-tetrahydro-2a,4a-diazacyclopenta[cd]azulene-2-carboxamide [ACD/IUPAC Name]
N-(3-Méthoxyphényl)-1,4-bis(4-méthoxyphényl)-5,6,7,8-tétrahydro-2a,4a-diazacyclopenta[cd]azulène-2-carboxamide [French] [ACD/IUPAC Name]
877789-96-3 [RN]
AC1MV6ZL
AGN-PC-0KYVES
AKOS005702613
MCULE-5779269059
MolPort-002-634-681
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    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: 1.641
    Molar Refractivity: 150.2±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 2
    ACD/LogP: 6.66
    ACD/LogD (pH 5.5): 5.29
    ACD/BCF (pH 5.5): 6216.50
    ACD/KOC (pH 5.5): 18072.22
    ACD/LogD (pH 7.4): 5.29
    ACD/BCF (pH 7.4): 6216.52
    ACD/KOC (pH 7.4): 18072.28
    Polar Surface Area: 66 Å2
    Polarizability: 59.5±0.5 10-24cm3
    Surface Tension: 47.0±7.0 dyne/cm
    Molar Volume: 416.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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