ChemSpider 2D Image | Ethyl (2E)-5-(2-methoxyphenyl)-7-methyl-2-{[5-(4-methyl-1-piperazinyl)-2-furyl]methylene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate | C27H30N4O5S

Ethyl (2E)-5-(2-methoxyphenyl)-7-methyl-2-{[5-(4-methyl-1-piperazinyl)-2-furyl]methylene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

  • Molecular FormulaC27H30N4O5S
  • Average mass522.616 Da
  • Monoisotopic mass522.193665 Da
  • ChemSpider ID7792950

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-5-(2-Méthoxyphényl)-7-méthyl-2-{[5-(4-méthyl-1-pipérazinyl)-2-furyl]méthylène}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate d'éthyle [French] [ACD/IUPAC Name]
5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 2,3-dihydro-5-(2-methoxyphenyl)-7-methyl-2-[[5-(4-methyl-1-piperazinyl)-2-furanyl]methylene]-3-oxo-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-5-(2-methoxyphenyl)-7-methyl-2-{[5-(4-methyl-1-piperazinyl)-2-furyl]methylene}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
Ethyl-(2E)-5-(2-methoxyphenyl)-7-methyl-2-{[5-(4-methyl-1-piperazinyl)-2-furyl]methylen}-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]
(E)-ethyl 5-(2-methoxyphenyl)-7-methyl-2-((5-(4-methylpiperazin-1-yl)furan-2-yl)methylene)-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
491583-34-7 [RN]
ethyl (2E)-5-(2-methoxyphenyl)-7-methyl-2-[[5-(4-methylpiperazin-1-yl)furan-2-yl]methylidene]-3-oxo-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
XBHXKOIZLLIIKT-LTGZKZEYSA-N

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

AN-698/40716519 [DBID]

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

    Density: 1.4±0.1 g/cm3
    Boiling Point: 654.2±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.0 mmHg at 25°C
    Enthalpy of Vaporization: 96.4±3.0 kJ/mol
    Flash Point: 349.5±34.3 °C
    Index of Refraction: 1.657
    Molar Refractivity: 142.1±0.5 cm3
    #H bond acceptors: 9
    #H bond donors: 0
    #Freely Rotating Bonds: 7
    #Rule of 5 Violations: 1
    ACD/LogP: 4.66
    ACD/LogD (pH 5.5): 1.38
    ACD/BCF (pH 5.5): 2.29
    ACD/KOC (pH 5.5): 18.14
    ACD/LogD (pH 7.4): 2.97
    ACD/BCF (pH 7.4): 89.11
    ACD/KOC (pH 7.4): 704.78
    Polar Surface Area: 113 Å2
    Polarizability: 56.3±0.5 10-24cm3
    Surface Tension: 51.2±7.0 dyne/cm
    Molar Volume: 386.2±7.0 cm3

    Click to predict properties on the Chemicalize site


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