ChemSpider 2D Image | O-DESMETHYL RANOLAZINE | C23H31N3O4

O-DESMETHYL RANOLAZINE

  • Molecular FormulaC23H31N3O4
  • Average mass413.510 Da
  • Monoisotopic mass413.231445 Da
  • ChemSpider ID23976726

More details:

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

172430-45-4 [RN]
1-Piperazineacetamide, N-(2,6-dimethylphenyl)-4-[2-hydroxy-3-(2-hydroxyphenoxy)propyl]- [ACD/Index Name]
N-(2,6-Dimethylphenyl)-2-{4-[2-hydroxy-3-(2-hydroxyphenoxy)propyl]-1-piperazinyl}acetamid [German] [ACD/IUPAC Name]
N-(2,6-Dimethylphenyl)-2-{4-[2-hydroxy-3-(2-hydroxyphenoxy)propyl]-1-piperazinyl}acetamide [ACD/IUPAC Name]
N-(2,6-Diméthylphényl)-2-{4-[2-hydroxy-3-(2-hydroxyphénoxy)propyl]-1-pipérazinyl}acétamide [French] [ACD/IUPAC Name]
O-DESMETHYL RANOLAZINE
1329834-18-5 [RN]
1-piperazineacetamide,n-(2,6-dimethylphenyl)-4-[2-hydroxy-3-(2-hydroxyphenoxy)propyl]-
Desmethyl Ranolazine
desmethyl ranolazine-d5
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

0G2S752Q5J [DBID]
UNII:0G2S752Q5J [DBID]

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 643.2±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 99.7±3.0 kJ/mol
    Flash Point: 342.8±31.5 °C
    Index of Refraction: 1.610
    Molar Refractivity: 117.4±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 3
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 2.70
    ACD/LogD (pH 5.5): 1.27
    ACD/BCF (pH 5.5): 3.43
    ACD/KOC (pH 5.5): 48.77
    ACD/LogD (pH 7.4): 2.07
    ACD/BCF (pH 7.4): 21.63
    ACD/KOC (pH 7.4): 307.36
    Polar Surface Area: 85 Å2
    Polarizability: 46.5±0.5 10-24cm3
    Surface Tension: 55.0±3.0 dyne/cm
    Molar Volume: 338.5±3.0 cm3

    Click to predict properties on the Chemicalize site


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