ChemSpider 2D Image | N-(4-{(2S)-4-[4-(3-Fluoro-4-pyridinyl)-1-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl]-2-morpholinyl}phenyl)-2-(4-methyl-1-piperazinyl)acetamide | C27H32FN7O3

N-(4-{(2S)-4-[4-(3-Fluoro-4-pyridinyl)-1-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl]-2-morpholinyl}phenyl)-2-(4-methyl-1-piperazinyl)acetamide

  • Molecular FormulaC27H32FN7O3
  • Average mass521.586 Da
  • Monoisotopic mass521.255066 Da
  • ChemSpider ID58915488

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

1-Piperazineacetamide, N-[4-[(2S)-4-[4-(3-fluoro-4-pyridinyl)-1,6-dihydro-1-methyl-6-oxo-2-pyrimidinyl]-2-morpholinyl]phenyl]-4-methyl- [ACD/Index Name]
N-(4-{(2S)-4-[4-(3-Fluor-4-pyridinyl)-1-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl]-2-morpholinyl}phenyl)-2-(4-methyl-1-piperazinyl)acetamid [German] [ACD/IUPAC Name]
N-(4-{(2S)-4-[4-(3-Fluoro-4-pyridinyl)-1-methyl-6-oxo-1,6-dihydro-2-pyrimidinyl]-2-morpholinyl}phenyl)-2-(4-methyl-1-piperazinyl)acetamide [ACD/IUPAC Name]
N-(4-{(2S)-4-[4-(3-Fluoro-4-pyridinyl)-1-méthyl-6-oxo-1,6-dihydro-2-pyrimidinyl]-2-morpholinyl}phényl)-2-(4-méthyl-1-pipérazinyl)acétamide [French] [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:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.661
Molar Refractivity: 141.8±0.5 cm3
#H bond acceptors: 10
#H bond donors: 1
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 2
ACD/LogP: -0.44
ACD/LogD (pH 5.5): -1.83
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 1.00
ACD/LogD (pH 7.4): -0.25
ACD/BCF (pH 7.4): 1.00
ACD/KOC (pH 7.4): 12.91
Polar Surface Area: 94 Å2
Polarizability: 56.2±0.5 10-24cm3
Surface Tension: 52.9±7.0 dyne/cm
Molar Volume: 383.5±7.0 cm3

Click to predict properties on the Chemicalize site


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