ChemSpider 2D Image | MFCD03417332 | C30H32N2O7S

MFCD03417332

  • Molecular FormulaC30H32N2O7S
  • Average mass564.649 Da
  • Monoisotopic mass564.192993 Da
  • ChemSpider ID4788723

  • Double-bond stereo - Double-bond stereo

More details:

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

(2E)-5-(4-Acétoxy-3-méthoxyphényl)-7-méthyl-3-oxo-2-[4-(pentyloxy)benzylidène]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate de méthyle [French] [ACD/IUPAC Name]
5H-Thiazolo[3,2-a]pyrimidine-6-carboxylic acid, 5-[4-(acetyloxy)-3-methoxyphenyl]-2,3-dihydro-7-methyl-3-oxo-2-[[4-(pentyloxy)phenyl]methylene]-, methyl ester, (2E)- [ACD/Index Name]
Methyl (2E)-5-(4-acetoxy-3-methoxyphenyl)-7-methyl-3-oxo-2-[4-(pentyloxy)benzylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
methyl (2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-7-methyl-3-oxo-2-[4-(pentyloxy)benzylidene]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate
Methyl-(2E)-5-(4-acetoxy-3-methoxyphenyl)-7-methyl-3-oxo-2-[4-(pentyloxy)benzyliden]-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]
MFCD03417332
(E)-methyl 5-(4-acetoxy-3-methoxyphenyl)-7-methyl-3-oxo-2-(4-(pentyloxy)benzylidene)-3,5-dihydro-2H-thiazolo[3,2-a]pyrimidine-6-carboxylate
2-methoxy-4-{6-(methoxycarbonyl)-7-methyl-3-oxo-2-[(4-pentyloxyphenyl)methylene](4,5-dihydro-1,3-thiazolidino[3,2-a]pyrimidin-5-yl)}phenyl acetate
518983-97-6 [RN]
methyl (2E)-5-[4-(acetyloxy)-3-methoxyphenyl]-7-methyl-3-oxo-2-{[4-(pentyloxy)phenyl]methylidene}-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: 666.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.0 mmHg at 25°C
Enthalpy of Vaporization: 97.9±3.0 kJ/mol
Flash Point: 356.6±34.3 °C
Index of Refraction: 1.603
Molar Refractivity: 152.6±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 12
#Rule of 5 Violations: 2
ACD/LogP: 6.25
ACD/LogD (pH 5.5): 5.17
ACD/BCF (pH 5.5): 4975.74
ACD/KOC (pH 5.5): 15410.02
ACD/LogD (pH 7.4): 5.17
ACD/BCF (pH 7.4): 4975.74
ACD/KOC (pH 7.4): 15410.02
Polar Surface Area: 129 Å2
Polarizability: 60.5±0.5 10-24cm3
Surface Tension: 45.4±7.0 dyne/cm
Molar Volume: 444.1±7.0 cm3

Click to predict properties on the Chemicalize site


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