ChemSpider 2D Image | 2-({[1-(2-Bromophenyl)ethyl]amino}methyl)-7-chloro-4H-pyrido[1,2-a]pyrimidin-4-one | C17H15BrClN3O

2-({[1-(2-Bromophenyl)ethyl]amino}methyl)-7-chloro-4H-pyrido[1,2-a]pyrimidin-4-one

  • Molecular FormulaC17H15BrClN3O
  • Average mass392.677 Da
  • Monoisotopic mass391.008698 Da
  • ChemSpider ID21688815

More details:

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

2-({[1-(2-Bromophenyl)ethyl]amino}methyl)-7-chloro-4H-pyrido[1,2-a]pyrimidin-4-one [ACD/IUPAC Name]
2-({[1-(2-Bromophényl)éthyl]amino}méthyl)-7-chloro-4H-pyrido[1,2-a]pyrimidin-4-one [French] [ACD/IUPAC Name]
2-({[1-(2-Bromphenyl)ethyl]amino}methyl)-7-chlor-4H-pyrido[1,2-a]pyrimidin-4-on [German] [ACD/IUPAC Name]
4H-Pyrido[1,2-a]pyrimidin-4-one, 2-[[[1-(2-bromophenyl)ethyl]amino]methyl]-7-chloro- [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: 468.1±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.2 mmHg at 25°C
Enthalpy of Vaporization: 73.0±3.0 kJ/mol
Flash Point: 236.9±31.5 °C
Index of Refraction: 1.664
Molar Refractivity: 96.1±0.5 cm3
#H bond acceptors: 4
#H bond donors: 1
#Freely Rotating Bonds: 4
#Rule of 5 Violations: 0
ACD/LogP: 3.47
ACD/LogD (pH 5.5): 0.16
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.48
ACD/LogD (pH 7.4): 1.70
ACD/BCF (pH 7.4): 5.59
ACD/KOC (pH 7.4): 50.71
Polar Surface Area: 45 Å2
Polarizability: 38.1±0.5 10-24cm3
Surface Tension: 50.4±7.0 dyne/cm
Molar Volume: 259.2±7.0 cm3

Click to predict properties on the Chemicalize site


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