Found 47 results

Search term: MF = 'C_{31}H_{28}N_{2}O_{6}S_{2}'
ChemSpider 2D Image | Ethyl (2Z)-2-({5-[4-(ethoxycarbonyl)phenyl]-2-furyl}methylene)-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate | C31H28N2O6S2

Ethyl (2Z)-2-({5-[4-(ethoxycarbonyl)phenyl]-2-furyl}methylene)-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

  • Molecular FormulaC31H28N2O6S2
  • Average mass588.694 Da
  • Monoisotopic mass588.138855 Da
  • ChemSpider ID12980458

  • Double-bond stereo - Double-bond stereo

More details:

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

(2Z)-2-({5-[4-(Éthoxycarbonyl)phényl]-2-furyl}méthylène)-7-méthyl-5-[4-(méthylsulfanyl)phényl]-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-[[5-[4-(ethoxycarbonyl)phenyl]-2-furanyl]methylene]-2,3-dihydro-7-methyl-5-[4-(methylthio)phenyl]-3-oxo-, ethyl ester, (2Z)- [ACD/Index Name]
Ethyl (2Z)-2-({5-[4-(ethoxycarbonyl)phenyl]-2-furyl}methylene)-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
Ethyl-(2Z)-2-({5-[4-(ethoxycarbonyl)phenyl]-2-furyl}methylen)-7-methyl-5-[4-(methylsulfanyl)phenyl]-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]
ETHYL (2Z)-2-[[5-(4-ETHOXYCARBONYLPHENYL)FURAN-2-YL]METHYLIDENE]-7-METHYL-5-(4-METHYLSULFANYLPHENYL)-3-OXO-5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-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: 719.3±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.3 mmHg at 25°C
Enthalpy of Vaporization: 105.1±3.0 kJ/mol
Flash Point: 388.8±35.7 °C
Index of Refraction: 1.653
Molar Refractivity: 161.3±0.5 cm3
#H bond acceptors: 8
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: 7.84
ACD/LogD (pH 5.5): 6.27
ACD/BCF (pH 5.5): 34333.38
ACD/KOC (pH 5.5): 61411.54
ACD/LogD (pH 7.4): 6.27
ACD/BCF (pH 7.4): 34333.38
ACD/KOC (pH 7.4): 61411.54
Polar Surface Area: 149 Å2
Polarizability: 63.9±0.5 10-24cm3
Surface Tension: 50.5±7.0 dyne/cm
Molar Volume: 440.5±7.0 cm3

Click to predict properties on the Chemicalize site


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