Found 87 results

Search term: MF = 'C_{36}H_{43}N_{3}O_{6}'
ChemSpider 2D Image | N-[(7S)-10-{[6-(3,4-Dihydro-2(1H)-isoquinolinyl)-6-oxohexyl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide | C36H43N3O6

N-[(7S)-10-{[6-(3,4-Dihydro-2(1H)-isoquinolinyl)-6-oxohexyl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide

  • Molecular FormulaC36H43N3O6
  • Average mass613.743 Da
  • Monoisotopic mass613.315186 Da
  • ChemSpider ID30718086

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

Acetamide, N-[(7S)-10-[[6-(3,4-dihydro-2(1H)-isoquinolinyl)-6-oxohexyl]amino]-5,6,7,9-tetrahydro-1,2,3-trimethoxy-9-oxobenzo[a]heptalen-7-yl]- [ACD/Index Name]
N-[(7S)-10-{[6-(3,4-Dihydro-2(1H)-isochinolinyl)-6-oxohexyl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamid [German] [ACD/IUPAC Name]
N-[(7S)-10-{[6-(3,4-Dihydro-2(1H)-isoquinoléinyl)-6-oxohexyl]amino}-1,2,3-triméthoxy-9-oxo-5,6,7,9-tétrahydrobenzo[a]heptalén-7-yl]acétamide [French] [ACD/IUPAC Name]
N-[(7S)-10-{[6-(3,4-Dihydro-2(1H)-isoquinolinyl)-6-oxohexyl]amino}-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide [ACD/IUPAC Name]
(S)-N-(10-((6-(3,4-dihydroisoquinolin-2(1H)-yl)-6-oxohexyl)amino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl)acetamide
1574390-06-9 [RN]
N-[(7S)-10-[[6-(3,4-dihydro-1H-isoquinolin-2-yl)-6-oxohexyl]amino]-1,2,3-trimethoxy-9-oxo-6,7-dihydro-5H-benzo[a]heptalen-7-yl]acetamide

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 920.4±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±0.3 mmHg at 25°C
    Enthalpy of Vaporization: 133.9±3.0 kJ/mol
    Flash Point: 510.4±34.3 °C
    Index of Refraction: 1.620
    Molar Refractivity: 172.2±0.4 cm3
    #H bond acceptors: 9
    #H bond donors: 2
    #Freely Rotating Bonds: 11
    #Rule of 5 Violations: 1
    ACD/LogP: 3.12
    ACD/LogD (pH 5.5): 3.50
    ACD/BCF (pH 5.5): 269.32
    ACD/KOC (pH 5.5): 1909.81
    ACD/LogD (pH 7.4): 3.50
    ACD/BCF (pH 7.4): 269.77
    ACD/KOC (pH 7.4): 1912.97
    Polar Surface Area: 106 Å2
    Polarizability: 68.3±0.5 10-24cm3
    Surface Tension: 57.6±5.0 dyne/cm
    Molar Volume: 490.2±5.0 cm3

    Click to predict properties on the Chemicalize site


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