ChemSpider 2D Image | 2-[5-(4-Fluorobenzyl)-1,3-thiazol-2-yl]-3-hydroxy-9-(3-isopropyl-2-oxo-1-imidazolidinyl)-7-(4-morpholinyl)-4H-pyrido[1,2-a]pyrimidin-4-one | C28H29FN6O4S

2-[5-(4-Fluorobenzyl)-1,3-thiazol-2-yl]-3-hydroxy-9-(3-isopropyl-2-oxo-1-imidazolidinyl)-7-(4-morpholinyl)-4H-pyrido[1,2-a]pyrimidin-4-one

  • Molecular FormulaC28H29FN6O4S
  • Average mass564.631 Da
  • Monoisotopic mass564.195496 Da
  • ChemSpider ID25052072

More details:

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

2-[5-(4-Fluorbenzyl)-1,3-thiazol-2-yl]-3-hydroxy-9-(3-isopropyl-2-oxo-1-imidazolidinyl)-7-(4-morpholinyl)-4H-pyrido[1,2-a]pyrimidin-4-on [German] [ACD/IUPAC Name]
2-[5-(4-Fluorobenzyl)-1,3-thiazol-2-yl]-3-hydroxy-9-(3-isopropyl-2-oxo-1-imidazolidinyl)-7-(4-morpholinyl)-4H-pyrido[1,2-a]pyrimidin-4-one [ACD/IUPAC Name]
2-[5-(4-Fluorobenzyl)-1,3-thiazol-2-yl]-3-hydroxy-9-(3-isopropyl-2-oxo-1-imidazolidinyl)-7-(4-morpholinyl)-4H-pyrido[1,2-a]pyrimidin-4-one [French] [ACD/IUPAC Name]
4H-Pyrido[1,2-a]pyrimidin-4-one, 2-[5-[(4-fluorophenyl)methyl]-2-thiazolyl]-3-hydroxy-9-[3-(1-methylethyl)-2-oxo-1-imidazolidinyl]-7-(4-morpholinyl)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point: 662.4±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 102.4±3.0 kJ/mol
Flash Point: 354.4±34.3 °C
Index of Refraction: 1.721
Molar Refractivity: 149.5±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: 1.41
ACD/LogD (pH 5.5): 1.50
ACD/BCF (pH 5.5): 7.74
ACD/KOC (pH 5.5): 143.17
ACD/LogD (pH 7.4): 0.40
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 11.41
Polar Surface Area: 130 Å2
Polarizability: 59.3±0.5 10-24cm3
Surface Tension: 60.3±7.0 dyne/cm
Molar Volume: 378.0±7.0 cm3

Click to predict properties on the Chemicalize site


Advertisement