ChemSpider 2D Image | (R)-tert-Butyl 2-((7-chloropyrido[4,3-b]pyrazin-5-ylamino)methyl)morpholine-4-carboxylate | C17H22ClN5O3

(R)-tert-Butyl 2-((7-chloropyrido[4,3-b]pyrazin-5-ylamino)methyl)morpholine-4-carboxylate

  • Molecular FormulaC17H22ClN5O3
  • Average mass379.841 Da
  • Monoisotopic mass379.141113 Da
  • ChemSpider ID58171398

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

(2R)-2-{[(7-Chloropyrido[3,4-b]pyrazin-5-yl)amino]méthyl}-4-morpholinecarboxylate de 2-méthyl-2-propanyle [French] [ACD/IUPAC Name]
(R)-tert-Butyl 2-((7-chloropyrido[4,3-b]pyrazin-5-ylamino)methyl)morpholine-4-carboxylate
1400589-53-8 [RN]
2-Methyl-2-propanyl (2R)-2-{[(7-chloropyrido[3,4-b]pyrazin-5-yl)amino]methyl}-4-morpholinecarboxylate [ACD/IUPAC Name]
2-Methyl-2-propanyl-(2R)-2-{[(7-chlorpyrido[3,4-b]pyrazin-5-yl)amino]methyl}-4-morpholincarboxylat [German] [ACD/IUPAC Name]
4-Morpholinecarboxylic acid, 2-[[(7-chloropyrido[3,4-b]pyrazin-5-yl)amino]methyl]-, 1,1-dimethylethyl ester, (2R)- [ACD/Index Name]
DS-19375
MFCD30478724

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

    Density: 1.3±0.1 g/cm3
    Boiling Point: 552.9±50.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.5 mmHg at 25°C
    Enthalpy of Vaporization: 83.4±3.0 kJ/mol
    Flash Point: 288.2±30.1 °C
    Index of Refraction: 1.610
    Molar Refractivity: 99.3±0.3 cm3
    #H bond acceptors: 8
    #H bond donors: 1
    #Freely Rotating Bonds: 5
    #Rule of 5 Violations: 0
    ACD/LogP: 2.67
    ACD/LogD (pH 5.5): 3.32
    ACD/BCF (pH 5.5): 197.29
    ACD/KOC (pH 5.5): 1525.44
    ACD/LogD (pH 7.4): 3.33
    ACD/BCF (pH 7.4): 198.94
    ACD/KOC (pH 7.4): 1538.22
    Polar Surface Area: 89 Å2
    Polarizability: 39.4±0.5 10-24cm3
    Surface Tension: 60.3±3.0 dyne/cm
    Molar Volume: 286.4±3.0 cm3

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