ChemSpider 2D Image | N-{(2S,3S)-1-(2-Hydroxy-2-methylpropanoyl)-2-[(2,3',5'-trifluoro-3-biphenylyl)methyl]-3-pyrrolidinyl}methanesulfonamide | C22H25F3N2O4S

N-{(2S,3S)-1-(2-Hydroxy-2-methylpropanoyl)-2-[(2,3',5'-trifluoro-3-biphenylyl)methyl]-3-pyrrolidinyl}methanesulfonamide

  • Molecular FormulaC22H25F3N2O4S
  • Average mass470.505 Da
  • Monoisotopic mass470.148712 Da
  • ChemSpider ID115009503

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

Methanesulfonamide, N-[(2S,3S)-1-(2-hydroxy-2-methyl-1-oxopropyl)-2-[(2,3',5'-trifluoro[1,1'-biphenyl]-3-yl)methyl]-3-pyrrolidinyl]- [ACD/Index Name]
N-{(2S,3S)-1-(2-Hydroxy-2-methylpropanoyl)-2-[(2,3',5'-trifluor-3-biphenylyl)methyl]-3-pyrrolidinyl}methansulfonamid [German] [ACD/IUPAC Name]
N-{(2S,3S)-1-(2-Hydroxy-2-methylpropanoyl)-2-[(2,3',5'-trifluoro-3-biphenylyl)methyl]-3-pyrrolidinyl}methanesulfonamide [ACD/IUPAC Name]
N-{(2S,3S)-1-(2-Hydroxy-2-méthylpropanoyl)-2-[(2,3',5'-trifluoro-3-biphénylyl)méthyl]-3-pyrrolidinyl}méthanesulfonamide [French] [ACD/IUPAC Name]
2274802-95-6 [RN]
Firazorexton

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

Density: 1.4±0.1 g/cm3
Boiling Point: 605.5±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.8 mmHg at 25°C
Enthalpy of Vaporization: 94.7±3.0 kJ/mol
Flash Point: 320.0±34.3 °C
Index of Refraction: 1.593
Molar Refractivity: 114.0±0.4 cm3
#H bond acceptors: 6
#H bond donors: 2
#Freely Rotating Bonds: 6
#Rule of 5 Violations: 0
ACD/LogP: 3.04
ACD/LogD (pH 5.5): 2.81
ACD/BCF (pH 5.5): 80.52
ACD/KOC (pH 5.5): 805.10
ACD/LogD (pH 7.4): 2.81
ACD/BCF (pH 7.4): 80.27
ACD/KOC (pH 7.4): 802.57
Polar Surface Area: 95 Å2
Polarizability: 45.2±0.5 10-24cm3
Surface Tension: 55.2±5.0 dyne/cm
Molar Volume: 336.7±5.0 cm3

Click to predict properties on the Chemicalize site


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