ChemSpider 2D Image | (4-{4-[5-(Adamantan-1-yl)-2-methoxybenzoyl]-1-piperazinyl}-3-nitrophenyl)(4-morpholinyl)methanone | C33H40N4O6

(4-{4-[5-(Adamantan-1-yl)-2-methoxybenzoyl]-1-piperazinyl}-3-nitrophenyl)(4-morpholinyl)methanone

  • Molecular FormulaC33H40N4O6
  • Average mass588.694 Da
  • Monoisotopic mass588.294800 Da
  • ChemSpider ID23081257

More details:

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

(4-{4-[2-methoxy-5-(tricyclo[3.3.1.13,7]dec-1-yl)benzoyl]piperazin-1-yl}-3-nitrophenyl)(morpholin-4-yl)methanone
(4-{4-[5-(Adamantan-1-yl)-2-methoxybenzoyl]-1-piperazinyl}-3-nitrophenyl)(4-morpholinyl)methanon [German] [ACD/IUPAC Name]
(4-{4-[5-(Adamantan-1-yl)-2-methoxybenzoyl]-1-piperazinyl}-3-nitrophenyl)(4-morpholinyl)methanone [ACD/IUPAC Name]
(4-{4-[5-(Adamantan-1-yl)-2-méthoxybenzoyl]-1-pipérazinyl}-3-nitrophényl)(4-morpholinyl)méthanone [French] [ACD/IUPAC Name]
Methanone, [4-[4-(2-methoxy-5-tricyclo[3.3.1.13,7]dec-1-ylbenzoyl)-1-piperazinyl]-3-nitrophenyl]-4-morpholinyl- [ACD/Index Name]
[4-[4-[5-(1-adamantyl)-2-methoxybenzoyl]piperazin-1-yl]-3-nitrophenyl]-morpholin-4-ylmethanone
4-(4-{4-[5-(1-adamantyl)-2-methoxybenzoyl]piperazin-1-yl}-3-nitrobenzoyl)morpholine
4-(4-{4-[5-(adamantan-1-yl)-2-methoxybenzoyl]piperazin-1-yl}-3-nitrobenzoyl)morpholine
4-{4-[(5-adamantanyl-2-methoxyphenyl)carbonyl]piperazinyl}-3-nitrophenyl morpholin-4-yl ketone
909246-09-9 [RN]
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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: 801.5±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.8 mmHg at 25°C
    Enthalpy of Vaporization: 116.5±3.0 kJ/mol
    Flash Point: 438.5±34.3 °C
    Index of Refraction: 1.629
    Molar Refractivity: 160.2±0.3 cm3
    #H bond acceptors: 10
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 4.04
    ACD/LogD (pH 5.5): 4.01
    ACD/BCF (pH 5.5): 663.30
    ACD/KOC (pH 5.5): 3642.33
    ACD/LogD (pH 7.4): 4.01
    ACD/BCF (pH 7.4): 663.30
    ACD/KOC (pH 7.4): 3642.36
    Polar Surface Area: 108 Å2
    Polarizability: 63.5±0.5 10-24cm3
    Surface Tension: 57.9±3.0 dyne/cm
    Molar Volume: 450.7±3.0 cm3

    Click to predict properties on the Chemicalize site


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