ChemSpider 2D Image | Ethyl 5-(2,7-dimethoxy-1-naphthyl)-7-methyl-3-oxo-2-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate | C39H35N3O6S

Ethyl 5-(2,7-dimethoxy-1-naphthyl)-7-methyl-3-oxo-2-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate

  • Molecular FormulaC39H35N3O6S
  • Average mass673.777 Da
  • Monoisotopic mass673.224670 Da
  • ChemSpider ID35398425

More details:

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

5-(2,7-Diméthoxy-1-naphtyl)-7-méthyl-3-oxo-2-{[1-(2-phénoxyéthyl)-1H-indol-3-yl]méthylène}-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-(2,7-dimethoxy-1-naphthalenyl)-2,3-dihydro-7-methyl-3-oxo-2-[[1-(2-phenoxyethyl)-1H-indol-3-yl]methylene]-, ethyl ester [ACD/Index Name]
Ethyl 5-(2,7-dimethoxy-1-naphthyl)-7-methyl-3-oxo-2-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylene}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidine-6-carboxylate [ACD/IUPAC Name]
Ethyl-5-(2,7-dimethoxy-1-naphthyl)-7-methyl-3-oxo-2-{[1-(2-phenoxyethyl)-1H-indol-3-yl]methylen}-2,3-dihydro-5H-[1,3]thiazolo[3,2-a]pyrimidin-6-carboxylat [German] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 828.5±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±3.0 mmHg at 25°C
Enthalpy of Vaporization: 120.4±3.0 kJ/mol
Flash Point: 454.9±37.1 °C
Index of Refraction: 1.655
Molar Refractivity: 189.7±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 11
#Rule of 5 Violations: 2
ACD/LogP: 8.75
ACD/LogD (pH 5.5): 7.21
ACD/BCF (pH 5.5): 176941.58
ACD/KOC (pH 5.5): 198597.00
ACD/LogD (pH 7.4): 7.21
ACD/BCF (pH 7.4): 176941.58
ACD/KOC (pH 7.4): 198597.00
Polar Surface Area: 117 Å2
Polarizability: 75.2±0.5 10-24cm3
Surface Tension: 49.6±7.0 dyne/cm
Molar Volume: 517.1±7.0 cm3

Click to predict properties on the Chemicalize site


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