ChemSpider 2D Image | 2-Chloro-N-(5-{3-[2-(dimethylamino)ethoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-7-yl}-2-methoxy-3-pyridinyl)-4-fluorobenzenesulfonamide | C24H23ClFN5O5S

2-Chloro-N-(5-{3-[2-(dimethylamino)ethoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-7-yl}-2-methoxy-3-pyridinyl)-4-fluorobenzenesulfonamide

  • Molecular FormulaC24H23ClFN5O5S
  • Average mass547.986 Da
  • Monoisotopic mass547.109253 Da
  • ChemSpider ID115007130

More details:

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

2-Chlor-N-(5-{3-[2-(dimethylamino)ethoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-7-yl}-2-methoxy-3-pyridinyl)-4-fluorbenzolsulfonamid [German] [ACD/IUPAC Name]
2-Chloro-N-(5-{3-[2-(dimethylamino)ethoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-7-yl}-2-methoxy-3-pyridinyl)-4-fluorobenzenesulfonamide [ACD/IUPAC Name]
2-Chloro-N-(5-{3-[2-(diméthylamino)éthoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-7-yl}-2-méthoxy-3-pyridinyl)-4-fluorobenzènesulfonamide [French] [ACD/IUPAC Name]
Benzenesulfonamide, 2-chloro-N-[5-[3-[2-(dimethylamino)ethoxy]-4-oxo-4H-pyrido[1,2-a]pyrimidin-7-yl]-2-methoxy-3-pyridinyl]-4-fluoro- [ACD/Index Name]
1845777-61-8 [RN]
2-chloro-N-[5-[3-[2-(dimethylamino)ethoxy]-4-oxopyrido[1,2-a]pyrimidin-7-yl]-2-methoxypyridin-3-yl]-4-fluorobenzenesulfonamide
Gilmelisib

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

Density: 1.4±0.1 g/cm3
Boiling Point: 680.0±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.1 mmHg at 25°C
Enthalpy of Vaporization: 99.8±3.0 kJ/mol
Flash Point: 365.1±34.3 °C
Index of Refraction: 1.642
Molar Refractivity: 137.3±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 9
#Rule of 5 Violations: 2
ACD/LogP: 3.59
ACD/LogD (pH 5.5): -0.05
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.13
ACD/LogD (pH 7.4): 0.78
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 7.73
Polar Surface Area: 122 Å2
Polarizability: 54.4±0.5 10-24cm3
Surface Tension: 52.0±7.0 dyne/cm
Molar Volume: 380.2±7.0 cm3

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