ChemSpider 2D Image | MFCD03418557 | C30H32N2O7S

MFCD03418557

  • Molecular FormulaC30H32N2O7S
  • Average mass564.649 Da
  • Monoisotopic mass564.192993 Da
  • ChemSpider ID12234279

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-5-(4-Acétoxy-3-éthoxyphényl)-2-(2-méthoxybenzylidène)-7-méthyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate d'isobutyle [French] [ACD/IUPAC Name]
5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-[4-(acetyloxy)-3-ethoxyphenyl]-2,3-dihydro-2-[(2-methoxyphenyl)methylene]-7-methyl-3-oxo-, 2-methylpropyl ester, (2E)- [ACD/Index Name]
Isobutyl (2E)-5-(4-acetoxy-3-ethoxyphenyl)-2-(2-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
ISOBUTYL (2E)-5-[4-(ACETYLOXY)-3-ETHOXYPHENYL]-2-(2-METHOXYBENZYLIDENE)-7-METHYL-3-OXO-2,3-DIHYDRO-5H-[1,3]THIAZOLO[3,2-A]PYRIMIDINE-6-CARBOXYLATE
Isobutyl-(2E)-5-(4-acetoxy-3-ethoxyphenyl)-2-(2-methoxybenzyliden)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]
MFCD03418557
(E)-isobutyl 5-(4-acetoxy-3-ethoxyphenyl)-2-(2-methoxybenzylidene)-7-methyl-3-oxo-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
2-ethoxy-4-{2-[(2-methoxyphenyl)methylene]-7-methyl-6-[(2-methylpropyl)oxycarbonyl]-3-oxo(4,5-dihydro-1,3-thiazolidino[3,2-a]pyrimidin-5-yl)}phenyl acetate
2-methylpropyl (2E)-5-[4-(acetyloxy)-3-ethoxyphenyl]-2-(2-methoxybenzylidene)-7-methyl-3-oxo-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
2-methylpropyl (2E)-5-[4-(acetyloxy)-3-ethoxyphenyl]-2-[(2-methoxyphenyl)methylidene]-7-methyl-3-oxo-2H,3H,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: 653.2±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 96.2±3.0 kJ/mol
Flash Point: 348.8±34.3 °C
Index of Refraction: 1.604
Molar Refractivity: 152.4±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 6.12
ACD/LogD (pH 5.5): 4.96
ACD/BCF (pH 5.5): 3451.40
ACD/KOC (pH 5.5): 11860.17
ACD/LogD (pH 7.4): 4.96
ACD/BCF (pH 7.4): 3451.40
ACD/KOC (pH 7.4): 11860.17
Polar Surface Area: 129 Å2
Polarizability: 60.4±0.5 10-24cm3
Surface Tension: 44.6±7.0 dyne/cm
Molar Volume: 443.3±7.0 cm3

Click to predict properties on the Chemicalize site


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