ChemSpider 2D Image | Methyl (4Z)-1-cyclohexyl-2-methyl-5-oxo-4-(4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate | C30H34N2O5

Methyl (4Z)-1-cyclohexyl-2-methyl-5-oxo-4-(4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate

  • Molecular FormulaC30H34N2O5
  • Average mass502.601 Da
  • Monoisotopic mass502.246765 Da
  • ChemSpider ID4831547

  • Double-bond stereo - Double-bond stereo

More details:

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

(4Z)-1-Cyclohexyl-2-méthyl-5-oxo-4-(4-{2-oxo-2-[(1-phényléthyl)amino]éthoxy}benzylidène)-4,5-dihydro-1H-pyrrole-3-carboxylate de méthyle [French] [ACD/IUPAC Name]
1H-Pyrrole-3-carboxylic acid, 1-cyclohexyl-4,5-dihydro-2-methyl-5-oxo-4-[[4-[2-oxo-2-[(1-phenylethyl)amino]ethoxy]phenyl]methylene]-, methyl ester, (4Z)- [ACD/Index Name]
Methyl (4Z)-1-cyclohexyl-2-methyl-5-oxo-4-(4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate [ACD/IUPAC Name]
Methyl-(4Z)-1-cyclohexyl-2-methyl-5-oxo-4-(4-{2-oxo-2-[(1-phenylethyl)amino]ethoxy}benzyliden)-4,5-dihydro-1H-pyrrol-3-carboxylat [German] [ACD/IUPAC Name]
(Z)-methyl 1-cyclohexyl-2-methyl-5-oxo-4-(4-(2-oxo-2-((1-phenylethyl)amino)ethoxy)benzylidene)-4,5-dihydro-1H-pyrrole-3-carboxylate
1-Cyclohexyl-2-methyl-5-oxo-4-{4-[(1-phenyl-ethylcarbamoyl)-methoxy]-benzylidene}-4,5-dihydro-1H-pyrrole-3-carboxylic acid methyl ester
358669-00-8 [RN]
METHYL (4Z)-1-CYCLOHEXYL-2-METHYL-5-OXO-4-[(4-{[(1-PHENYLETHYL)CARBAMOYL]METHOXY}PHENYL)METHYLIDENE]PYRROLE-3-CARBOXYLATE
methyl (4Z)-1-cyclohexyl-2-methyl-5-oxo-4-[[4-[2-oxo-2-(1-phenylethylamino)ethoxy]phenyl]methylidene]pyrrole-3-carboxylate

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

    Density: 1.2±0.1 g/cm3
    Boiling Point: 747.1±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.5 mmHg at 25°C
    Enthalpy of Vaporization: 108.9±3.0 kJ/mol
    Flash Point: 405.6±32.9 °C
    Index of Refraction: 1.608
    Molar Refractivity: 142.4±0.3 cm3
    #H bond acceptors: 7
    #H bond donors: 1
    #Freely Rotating Bonds: 9
    #Rule of 5 Violations: 2
    ACD/LogP: 5.15
    ACD/LogD (pH 5.5): 4.16
    ACD/BCF (pH 5.5): 854.97
    ACD/KOC (pH 5.5): 4368.10
    ACD/LogD (pH 7.4): 4.16
    ACD/BCF (pH 7.4): 854.97
    ACD/KOC (pH 7.4): 4368.10
    Polar Surface Area: 85 Å2
    Polarizability: 56.5±0.5 10-24cm3
    Surface Tension: 52.5±3.0 dyne/cm
    Molar Volume: 412.0±3.0 cm3

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