ChemSpider 2D Image | {3,5-Bis[(1-naphthylmethyl)amino]-1H-1,2,4-triazol-1-yl}(3,4,5-trimethoxyphenyl)methanone | C34H31N5O4

{3,5-Bis[(1-naphthylmethyl)amino]-1H-1,2,4-triazol-1-yl}(3,4,5-trimethoxyphenyl)methanone

  • Molecular FormulaC34H31N5O4
  • Average mass573.641 Da
  • Monoisotopic mass573.237610 Da
  • ChemSpider ID17519032

More details:

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

{3,5-Bis[(1-naphthylmethyl)amino]-1H-1,2,4-triazol-1-yl}(3,4,5-trimethoxyphenyl)methanon [German] [ACD/IUPAC Name]
{3,5-Bis[(1-naphthylmethyl)amino]-1H-1,2,4-triazol-1-yl}(3,4,5-trimethoxyphenyl)methanone [ACD/IUPAC Name]
{3,5-Bis[(1-naphtylméthyl)amino]-1H-1,2,4-triazol-1-yl}(3,4,5-triméthoxyphényl)méthanone [French] [ACD/IUPAC Name]
Methanone, [3,5-bis[(1-naphthalenylmethyl)amino]-1H-1,2,4-triazol-1-yl](3,4,5-trimethoxyphenyl)- [ACD/Index Name]
[3,5-bis(naphthalen-1-ylmethylamino)-1,2,4-triazol-1-yl]-(3,4,5-trimethoxyphenyl)methanone
{3,5-Bis-[(naphthalen-1-ylmethyl)-amino]-[1,2,4]triazol-1-yl}-(3,4,5-trimethoxy-phenyl)-methanone
{3,5-bis[(naphthalen-1-ylmethyl)amino]-1H-1,2,4-triazol-1-yl}(3,4,5-trimethoxyphenyl)methanone
767345-68-6 [RN]
N3,N5-bis(naphthalen-1-ylmethyl)-1-(3,4,5-trimethoxybenzoyl)-1,2,4-triazole-3,5-diamine
N3,N5-bis[(naphthalen-1-yl)methyl]-1-(3,4,5-trimethoxybenzoyl)-1H-1,2,4-triazole-3,5-diamine

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 818.1±75.0 °C at 760 mmHg
    Vapour Pressure: 0.0±3.0 mmHg at 25°C
    Enthalpy of Vaporization: 118.9±3.0 kJ/mol
    Flash Point: 448.6±37.1 °C
    Index of Refraction: 1.649
    Molar Refractivity: 164.6±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 10
    #Rule of 5 Violations: 2
    ACD/LogP: 6.86
    ACD/LogD (pH 5.5): 6.04
    ACD/BCF (pH 5.5): 23021.37
    ACD/KOC (pH 5.5): 46128.67
    ACD/LogD (pH 7.4): 6.04
    ACD/BCF (pH 7.4): 23026.57
    ACD/KOC (pH 7.4): 46139.11
    Polar Surface Area: 100 Å2
    Polarizability: 65.2±0.5 10-24cm3
    Surface Tension: 48.6±7.0 dyne/cm
    Molar Volume: 451.6±7.0 cm3

    Click to predict properties on the Chemicalize site


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