ChemSpider 2D Image | N-(3-{2,4-Bis[(3S)-3-methyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl}phenyl)-2-hydroxyethanesulfonamide | C25H32N6O5S

N-(3-{2,4-Bis[(3S)-3-methyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl}phenyl)-2-hydroxyethanesulfonamide

  • Molecular FormulaC25H32N6O5S
  • Average mass528.624 Da
  • Monoisotopic mass528.215515 Da
  • ChemSpider ID58890145

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Ethanesulfonamide, N-[3-[2,4-bis[(3S)-3-methyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl]phenyl]-2-hydroxy- [ACD/Index Name]
N-(3-{2,4-Bis[(3S)-3-methyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl}phenyl)-2-hydroxyethanesulfonamide [ACD/IUPAC Name]
N-(3-{2,4-Bis[(3S)-3-méthyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl}phényl)-2-hydroxyéthanesulfonamide [French] [ACD/IUPAC Name]
N-(3-{2,4-Bis[(3S)-3-methyl-4-morpholinyl]pyrido[2,3-d]pyrimidin-7-yl}phenyl)-2-hydroxyethansulfonamid [German] [ACD/IUPAC 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: 781.4±70.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.8 mmHg at 25°C
Enthalpy of Vaporization: 119.3±3.0 kJ/mol
Flash Point: 426.4±35.7 °C
Index of Refraction: 1.633
Molar Refractivity: 139.1±0.4 cm3
#H bond acceptors: 11
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: -0.03
ACD/LogD (pH 5.5): 0.81
ACD/BCF (pH 5.5): 1.94
ACD/KOC (pH 5.5): 42.70
ACD/LogD (pH 7.4): 0.62
ACD/BCF (pH 7.4): 1.26
ACD/KOC (pH 7.4): 27.68
Polar Surface Area: 138 Å2
Polarizability: 55.1±0.5 10-24cm3
Surface Tension: 63.5±3.0 dyne/cm
Molar Volume: 389.6±3.0 cm3

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