Found 74 results

Search term: MF = 'C_{30}H_{28}N_{2}O_{4}S_{2}'
ChemSpider 2D Image | Ethyl (2E)-2-(4-isobutoxybenzylidene)-3-oxo-7-phenyl-5-(2-thienyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate | C30H28N2O4S2

Ethyl (2E)-2-(4-isobutoxybenzylidene)-3-oxo-7-phenyl-5-(2-thienyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

  • Molecular FormulaC30H28N2O4S2
  • Average mass544.684 Da
  • Monoisotopic mass544.149048 Da
  • ChemSpider ID57304155

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-2-(4-Isobutoxybenzylidène)-3-oxo-7-phényl-5-(2-thiényl)-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-2-[[4-(2-methylpropoxy)phenyl]methylene]-3-oxo-7-phenyl-5-(2-thienyl)-, ethyl ester, (2E)- [ACD/Index Name]
Ethyl (2E)-2-(4-isobutoxybenzylidene)-3-oxo-7-phenyl-5-(2-thienyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
Ethyl-(2E)-2-(4-isobutoxybenzyliden)-3-oxo-7-phenyl-5-(2-thienyl)-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]
ETHYL (2E)-2-[[4-(2-METHYLPROPOXY)PHENYL]METHYLIDENE]-3-OXO-7-PHENYL-5-THIOPHEN-2-YL-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: 693.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.2 mmHg at 25°C
Enthalpy of Vaporization: 101.5±3.0 kJ/mol
Flash Point: 373.0±34.3 °C
Index of Refraction: 1.654
Molar Refractivity: 154.6±0.5 cm3
#H bond acceptors: 6
#H bond donors: 0
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 8.31
ACD/LogD (pH 5.5): 5.95
ACD/BCF (pH 5.5): 19590.96
ACD/KOC (pH 5.5): 41099.79
ACD/LogD (pH 7.4): 5.95
ACD/BCF (pH 7.4): 19590.96
ACD/KOC (pH 7.4): 41099.79
Polar Surface Area: 122 Å2
Polarizability: 61.3±0.5 10-24cm3
Surface Tension: 49.5±7.0 dyne/cm
Molar Volume: 421.7±7.0 cm3

Click to predict properties on the Chemicalize site


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