ChemSpider 2D Image | 5-[(2-Methoxyethyl)amino]-3-methyl-7-[3-(methylsulfonyl)-4-{[2-(4-morpholinyl)ethyl]amino}phenyl]pyrido[4,3-d]pyrimidin-4(3H)-one | C24H32N6O5S

5-[(2-Methoxyethyl)amino]-3-methyl-7-[3-(methylsulfonyl)-4-{[2-(4-morpholinyl)ethyl]amino}phenyl]pyrido[4,3-d]pyrimidin-4(3H)-one

  • Molecular FormulaC24H32N6O5S
  • Average mass516.613 Da
  • Monoisotopic mass516.215515 Da
  • ChemSpider ID58942105

More details:

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

5-[(2-Methoxyethyl)amino]-3-methyl-7-[3-(methylsulfonyl)-4-{[2-(4-morpholinyl)ethyl]amino}phenyl]pyrido[4,3-d]pyrimidin-4(3H)-on [German] [ACD/IUPAC Name]
5-[(2-Methoxyethyl)amino]-3-methyl-7-[3-(methylsulfonyl)-4-{[2-(4-morpholinyl)ethyl]amino}phenyl]pyrido[4,3-d]pyrimidin-4(3H)-one [ACD/IUPAC Name]
5-[(2-Méthoxyéthyl)amino]-3-méthyl-7-[3-(méthylsulfonyl)-4-{[2-(4-morpholinyl)éthyl]amino}phényl]pyrido[4,3-d]pyrimidin-4(3H)-one [French] [ACD/IUPAC Name]
Pyrido[4,3-d]pyrimidin-4(3H)-one, 5-[(2-methoxyethyl)amino]-3-methyl-7-[3-(methylsulfonyl)-4-[[2-(4-morpholinyl)ethyl]amino]phenyl]- [ACD/Index Name]

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

Density: 1.4±0.1 g/cm3
Boiling Point: 815.0±75.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.9 mmHg at 25°C
Enthalpy of Vaporization: 118.5±3.0 kJ/mol
Flash Point: 446.7±37.1 °C
Index of Refraction: 1.650
Molar Refractivity: 135.9±0.5 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 10
#Rule of 5 Violations: 2
ACD/LogP: -0.64
ACD/LogD (pH 5.5): -1.20
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): 0.72
ACD/BCF (pH 7.4): 1.93
ACD/KOC (pH 7.4): 50.87
Polar Surface Area: 134 Å2
Polarizability: 53.9±0.5 10-24cm3
Surface Tension: 54.3±7.0 dyne/cm
Molar Volume: 372.7±7.0 cm3

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