ChemSpider 2D Image | Ethyl 2-[(2-fluorobenzoyl)imino]-1-(3-isopropoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate | C27H27FN4O5

Ethyl 2-[(2-fluorobenzoyl)imino]-1-(3-isopropoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate

  • Molecular FormulaC27H27FN4O5
  • Average mass506.526 Da
  • Monoisotopic mass506.196533 Da
  • ChemSpider ID35353831

More details:

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

2-[(2-Fluorobenzoyl)imino]-1-(3-isopropoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate d'éthyle [French] [ACD/IUPAC Name]
2H-Dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylic acid, 2-[(2-fluorobenzoyl)imino]-1,5-dihydro-1-[3-(1-methylethoxy)propyl]-5-oxo-, ethyl ester [ACD/Index Name]
Ethyl 2-[(2-fluorobenzoyl)imino]-1-(3-isopropoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carboxylate [ACD/IUPAC Name]
Ethyl-2-[(2-fluorbenzoyl)imino]-1-(3-isopropoxypropyl)-5-oxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidin-3-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: 625.3±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 92.6±3.0 kJ/mol
Flash Point: 331.9±34.3 °C
Index of Refraction: 1.614
Molar Refractivity: 135.5±0.5 cm3
#H bond acceptors: 9
#H bond donors: 0
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 1
ACD/LogP: 1.92
ACD/LogD (pH 5.5): 2.31
ACD/BCF (pH 5.5): 33.28
ACD/KOC (pH 5.5): 427.77
ACD/LogD (pH 7.4): 2.31
ACD/BCF (pH 7.4): 33.28
ACD/KOC (pH 7.4): 427.77
Polar Surface Area: 101 Å2
Polarizability: 53.7±0.5 10-24cm3
Surface Tension: 47.1±7.0 dyne/cm
Molar Volume: 388.7±7.0 cm3

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