Found 186 results

Search term: MF = 'C_{32}H_{30}N_{2}O_{4}S'
ChemSpider 2D Image | Allyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-(benzylsulfanyl)-5-cyano-2-methyl-1,4-dihydro-3-pyridinecarboxylate | C32H30N2O4S

Allyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-(benzylsulfanyl)-5-cyano-2-methyl-1,4-dihydro-3-pyridinecarboxylate

  • Molecular FormulaC32H30N2O4S
  • Average mass538.657 Da
  • Monoisotopic mass538.192627 Da
  • ChemSpider ID2788606

More details:

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

3-Pyridinecarboxylic acid, 5-cyano-1,4-dihydro-4-[3-methoxy-4-(phenylmethoxy)phenyl]-2-methyl-6-[(phenylmethyl)thio]-, 2-propen-1-yl ester [ACD/Index Name]
4-[4-(Benzyloxy)-3-méthoxyphényl]-6-(benzylsulfanyl)-5-cyano-2-méthyl-1,4-dihydro-3-pyridinecarboxylate d'allyle [French] [ACD/IUPAC Name]
Allyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-(benzylsulfanyl)-5-cyano-2-methyl-1,4-dihydro-3-pyridinecarboxylate [ACD/IUPAC Name]
Allyl-4-[4-(benzyloxy)-3-methoxyphenyl]-6-(benzylsulfanyl)-5-cyan-2-methyl-1,4-dihydro-3-pyridincarboxylat [German] [ACD/IUPAC Name]
797773-03-6 [RN]
allyl 4-(4-(benzyloxy)-3-methoxyphenyl)-6-(benzylthio)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
Allyl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-(benzylsulfanyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
prop-2-en-1-yl 4-[4-(benzyloxy)-3-methoxyphenyl]-6-(benzylsulfanyl)-5-cyano-2-methyl-1,4-dihydropyridine-3-carboxylate
prop-2-enyl 6-benzylsulfanyl-5-cyano-4-(3-methoxy-4-phenylmethoxyphenyl)-2-methyl-1,4-dihydropyridine-3-carboxylate

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 682.5±55.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 100.1±3.0 kJ/mol
    Flash Point: 366.5±31.5 °C
    Index of Refraction: 1.640
    Molar Refractivity: 154.6±0.4 cm3
    #H bond acceptors: 6
    #H bond donors: 1
    #Freely Rotating Bonds: 13
    #Rule of 5 Violations: 2
    ACD/LogP: 6.18
    ACD/LogD (pH 5.5): 6.28
    ACD/BCF (pH 5.5): 35118.93
    ACD/KOC (pH 5.5): 62413.91
    ACD/LogD (pH 7.4): 6.28
    ACD/BCF (pH 7.4): 35119.13
    ACD/KOC (pH 7.4): 62414.25
    Polar Surface Area: 106 Å2
    Polarizability: 61.3±0.5 10-24cm3
    Surface Tension: 57.9±5.0 dyne/cm
    Molar Volume: 428.7±5.0 cm3

    Click to predict properties on the Chemicalize site


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