ChemSpider 2D Image | 2-[4-(5-{4-[(5S)-5-(Acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl}-2-pyridinyl)-1-piperazinyl]-2-oxoethyl acetate | C25H28FN5O6

2-[4-(5-{4-[(5S)-5-(Acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl}-2-pyridinyl)-1-piperazinyl]-2-oxoethyl acetate

  • Molecular FormulaC25H28FN5O6
  • Average mass513.518 Da
  • Monoisotopic mass513.202332 Da
  • ChemSpider ID8317937

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2-[4-(5-{4-[(5S)-5-(Acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophenyl}-2-pyridinyl)-1-piperazinyl]-2-oxoethyl acetate [ACD/IUPAC Name]
2-[4-(5-{4-[(5S)-5-(Acetamidomethyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorphenyl}-2-pyridinyl)-1-piperazinyl]-2-oxoethyl-acetat [German] [ACD/IUPAC Name]
Acetamide, N-[[(5S)-3-[4-[6-[4-[2-(acetyloxy)acetyl]-1-piperazinyl]-3-pyridinyl]-3-fluorophenyl]-2-oxo-5-oxazolidinyl]methyl]- [ACD/Index Name]
Acétate de 2-[4-(5-{4-[(5S)-5-(acétamidométhyl)-2-oxo-1,3-oxazolidin-3-yl]-2-fluorophényl}-2-pyridinyl)-1-pipérazinyl]-2-oxoéthyle [French] [ACD/IUPAC Name]

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

Density: 1.3±0.1 g/cm3
Boiling Point: 781.4±60.0 °C at 760 mmHg
Vapour Pressure: 0.0±2.7 mmHg at 25°C
Enthalpy of Vaporization: 113.7±3.0 kJ/mol
Flash Point: 426.3±32.9 °C
Index of Refraction: 1.578
Molar Refractivity: 127.9±0.3 cm3
#H bond acceptors: 11
#H bond donors: 1
#Freely Rotating Bonds: 8
#Rule of 5 Violations: 2
ACD/LogP: 1.13
ACD/LogD (pH 5.5): -0.14
ACD/BCF (pH 5.5): 1.00
ACD/KOC (pH 5.5): 3.38
ACD/LogD (pH 7.4): 1.31
ACD/BCF (pH 7.4): 5.13
ACD/KOC (pH 7.4): 96.38
Polar Surface Area: 121 Å2
Polarizability: 50.7±0.5 10-24cm3
Surface Tension: 54.2±3.0 dyne/cm
Molar Volume: 385.3±3.0 cm3

Click to predict properties on the Chemicalize site


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