ChemSpider 2D Image | Ethyl (2E)-5-[4-(dimethylamino)phenyl]-7-methyl-2-[(6-methyl-2-quinolinyl)methylene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate | C29H28N4O3S

Ethyl (2E)-5-[4-(dimethylamino)phenyl]-7-methyl-2-[(6-methyl-2-quinolinyl)methylene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

  • Molecular FormulaC29H28N4O3S
  • Average mass512.623 Da
  • Monoisotopic mass512.188232 Da
  • ChemSpider ID4453101

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-5-[4-(Diméthylamino)phényl]-7-méthyl-2-[(6-méthyl-2-quinoléinyl)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, 5-[4-(dimethylamino)phenyl]-2,3-dihydro-7-methyl-2-[(6-methyl-2-quinolinyl)methylene]-3-oxo-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-5-[4-(dimethylamino)phenyl]-7-methyl-2-[(6-methyl-2-quinolinyl)methylene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
Ethyl (2E)-5-[4-(dimethylamino)phenyl]-7-methyl-2-[(6-methylquinolin-2-yl)methylene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Ethyl-(2E)-5-[4-(dimethylamino)phenyl]-7-methyl-2-[(6-methyl-2-chinolinyl)methylen]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]
(E)-ethyl 5-(4-(dimethylamino)phenyl)-7-methyl-2-((6-methylquinolin-2-yl)methylene)-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
309920-61-4 [RN]
5-(4-Dimethylamino-phenyl)-7-methyl-2-(6-methyl-quinolin-2-ylmethylene)-3-oxo-2,3-dihydro-5H-thiazolo[3,2-a]pyrimidine-6-carboxylic acid ethyl ester
ETHYL (2E)-5-(4-DIMETHYLAMINOPHENYL)-7-METHYL-2-[(6-METHYLQUINOLIN-2-YL)METHYLIDENE]-3-OXO-5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
ethyl (2E)-5-[4-(dimethylamino)phenyl]-7-methyl-2-[(6-methylquinolin-2-yl)methylidene]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
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Validated by Experts, Validated by Users, Non-Validated, Removed by Users

A2259/0095136 [DBID]
AG-205/13764268 [DBID]

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 675.2±65.0 °C at 760 mmHg
    Vapour Pressure: 0.0±2.1 mmHg at 25°C
    Enthalpy of Vaporization: 99.2±3.0 kJ/mol
    Flash Point: 362.2±34.3 °C
    Index of Refraction: 1.662
    Molar Refractivity: 147.5±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 6
    #Rule of 5 Violations: 2
    ACD/LogP: 5.98
    ACD/LogD (pH 5.5): 4.89
    ACD/BCF (pH 5.5): 2933.35
    ACD/KOC (pH 5.5): 10121.10
    ACD/LogD (pH 7.4): 4.95
    ACD/BCF (pH 7.4): 3395.50
    ACD/KOC (pH 7.4): 11715.66
    Polar Surface Area: 100 Å2
    Polarizability: 58.5±0.5 10-24cm3
    Surface Tension: 48.3±7.0 dyne/cm
    Molar Volume: 398.4±7.0 cm3

    Click to predict properties on the Chemicalize site


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