ChemSpider 2D Image | SAR405 | C19H21ClF3N5O2

SAR405

  • Molecular FormulaC19H21ClF3N5O2
  • Average mass443.850 Da
  • Monoisotopic mass443.133575 Da
  • ChemSpider ID32674426

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(2S)-1-[(5-chloropyridin-3-yl)methyl]-8-[(3R)-3-methylmorpholin-4-yl]-2-(trifluoromethyl)-1H,2H,3H,4H,6H-pyrimido[1,2-a][1,3]diazin-6-one
(8S)-9-[(5-Chlor-3-pyridinyl)methyl]-2-[(3R)-3-methyl-4-morpholinyl]-8-(trifluormethyl)-6,7,8,9-tetrahydro-4H-pyrimido[1,2-a]pyrimidin-4-on [German] [ACD/IUPAC Name]
(8S)-9-[(5-Chloro-3-pyridinyl)methyl]-2-[(3R)-3-methyl-4-morpholinyl]-8-(trifluoromethyl)-6,7,8,9-tetrahydro-4H-pyrimido[1,2-a]pyrimidin-4-one [ACD/IUPAC Name]
(8S)-9-[(5-Chloro-3-pyridinyl)méthyl]-2-[(3R)-3-méthyl-4-morpholinyl]-8-(trifluorométhyl)-6,7,8,9-tétrahydro-4H-pyrimido[1,2-a]pyrimidin-4-one [French] [ACD/IUPAC Name]
(8S)-9-[(5-chloropyridin-3-yl)methyl]-2-[(3R)-3-methylmorpholin-4-yl]-8-(trifluoromethyl)-6H,7H,8H-pyrimido[1,2-a][1,3]diazin-4-one
1523406-39-4 [RN]
4H-Pyrimido[1,2-a]pyrimidin-4-one, 9-[(5-chloro-3-pyridinyl)methyl]-6,7,8,9-tetrahydro-2-[(3R)-3-methyl-4-morpholinyl]-8-(trifluoromethyl)-, (8S)- [ACD/Index Name]
SAR405
SAR-405
(2S)-1-[(5-chloropyridin-3-yl)methyl]-8-[(3R)-3-methylmorpholin-4-yl]-2-(trifluoromethyl)-1H,2H,3H,4H,6H-[1,3]diazino[1,2-a]pyrimidin-6-one
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    Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module, version: 14.00

    Density: 1.5±0.1 g/cm3
    Boiling Point: 526.5±60.0 °C at 760 mmHg
    Vapour Pressure: 0.0±1.4 mmHg at 25°C
    Enthalpy of Vaporization: 80.1±3.0 kJ/mol
    Flash Point: 272.2±32.9 °C
    Index of Refraction: 1.635
    Molar Refractivity: 104.7±0.5 cm3
    #H bond acceptors: 7
    #H bond donors: 0
    #Freely Rotating Bonds: 4
    #Rule of 5 Violations: 0
    ACD/LogP: 1.97
    ACD/LogD (pH 5.5): 1.82
    ACD/BCF (pH 5.5): 14.21
    ACD/KOC (pH 5.5): 232.19
    ACD/LogD (pH 7.4): 1.82
    ACD/BCF (pH 7.4): 14.30
    ACD/KOC (pH 7.4): 233.72
    Polar Surface Area: 61 Å2
    Polarizability: 41.5±0.5 10-24cm3
    Surface Tension: 48.7±7.0 dyne/cm
    Molar Volume: 292.3±7.0 cm3

    Click to predict properties on the Chemicalize site


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