ChemSpider 2D Image | N-({[3-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetyl)-D-norvaline | C26H27NO8

N-({[3-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetyl)-D-norvaline

  • Molecular FormulaC26H27NO8
  • Average mass481.495 Da
  • Monoisotopic mass481.173676 Da
  • ChemSpider ID21533506

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

D-Norvaline, N-[2-[[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-1-benzopyran-7-yl]oxy]acetyl]- [ACD/Index Name]
N-({[3-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetyl)-D-norvalin [German] [ACD/IUPAC Name]
N-({[3-(3,4-Dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl]oxy}acetyl)-D-norvaline [ACD/IUPAC Name]
N-(2-{[3-(3,4-Dihydro-2H-1,5-benzodioxépin-7-yl)-2-méthyl-4-oxo-4H-chromén-7-yl]oxy}acétyl)-D-norvaline [French] [ACD/IUPAC Name]
(2R)-2-[[2-[3-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-4-oxochromen-7-yl]oxyacetyl]amino]pentanoic acid
(2R)-2-[[2-[3-(3,4-DIHYDRO-2H-1,5-BENZODIOXEPIN-8-YL)-2-METHYL-4-OXOCHROMEN-7-YL]OXYACETYL]AMINO]PENTANOIC ACID
(R)-2-(2-((3-(3,4-dihydro-2H-benzo[b][1,4]dioxepin-7-yl)-2-methyl-4-oxo-4H-chromen-7-yl)oxy)acetamido)pentanoic acid
312963-19-2 [RN]
AC1LX99B
MCULE-5142305667
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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: 747.3±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.6 mmHg at 25°C
    Enthalpy of Vaporization: 114.3±3.0 kJ/mol
    Flash Point: 405.7±32.9 °C
    Index of Refraction: 1.589
    Molar Refractivity: 123.9±0.3 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 8
    #Rule of 5 Violations: 0
    ACD/LogP: 4.78
    ACD/LogD (pH 5.5): 1.06
    ACD/BCF (pH 5.5): 1.02
    ACD/KOC (pH 5.5): 7.58
    ACD/LogD (pH 7.4): -0.22
    ACD/BCF (pH 7.4): 1.00
    ACD/KOC (pH 7.4): 1.00
    Polar Surface Area: 120 Å2
    Polarizability: 49.1±0.5 10-24cm3
    Surface Tension: 53.0±3.0 dyne/cm
    Molar Volume: 367.9±3.0 cm3

    Click to predict properties on the Chemicalize site


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