Found 216 results

Search term: MF = 'C_{30}H_{39}N_{3}O_{7}'
ChemSpider 2D Image | N~2~-[(7S)-7-Acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(tetrahydro-2H-pyran-4-ylmethyl)-L-alaninamide | C30H39N3O7

N2-[(7S)-7-Acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(tetrahydro-2H-pyran-4-ylmethyl)-L-alaninamide

  • Molecular FormulaC30H39N3O7
  • Average mass553.647 Da
  • Monoisotopic mass553.278809 Da
  • ChemSpider ID30717105

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

N2-[(7S)-7-Acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(tetrahydro-2H-pyran-4-ylmethyl)-L-alaninamid [German] [ACD/IUPAC Name]
N2-[(7S)-7-Acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-(tetrahydro-2H-pyran-4-ylmethyl)-L-alaninamide [ACD/IUPAC Name]
N2-[(7S)-7-Acétamido-1,2,3-triméthoxy-9-oxo-5,6,7,9-tétrahydrobenzo[a]heptalén-10-yl]-N-(tétrahydro-2H-pyran-4-ylméthyl)-L-alaninamide [French] [ACD/IUPAC Name]
Propanamide, 2-[[(7S)-7-(acetylamino)-5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxobenzo[a]heptalen-10-yl]amino]-N-[(tetrahydro-2H-pyran-4-yl)methyl]-, (2S)- [ACD/Index Name]
(2S)-2-[[(7S)-7-acetamido-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-10-yl]amino]-N-(oxan-4-ylmethyl)propanamide
(S)-2-(((S)-7-acetamido-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl)amino)-N-((tetrahydro-2H-pyran-4-yl)methyl)propanamide
1574289-63-6 [RN]
MolPort-029-885-269

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 891.4±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 129.6±3.0 kJ/mol
    Flash Point: 492.9±34.3 °C
    Index of Refraction: 1.591
    Molar Refractivity: 149.0±0.4 cm3
    #H bond acceptors: 10
    #H bond donors: 3
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: 0.62
    ACD/LogD (pH 5.5): 1.10
    ACD/BCF (pH 5.5): 4.01
    ACD/KOC (pH 5.5): 94.09
    ACD/LogD (pH 7.4): 1.10
    ACD/BCF (pH 7.4): 4.01
    ACD/KOC (pH 7.4): 94.09
    Polar Surface Area: 124 Å2
    Polarizability: 59.1±0.5 10-24cm3
    Surface Tension: 54.3±5.0 dyne/cm
    Molar Volume: 440.9±5.0 cm3

    Click to predict properties on the Chemicalize site


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