ChemSpider 2D Image | 5-(Difluoromethyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-3-{[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]amino}-2(1H)-pyridinone | C25H23F3N4O2

5-(Difluoromethyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-3-{[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]amino}-2(1H)-pyridinone

  • Molecular FormulaC25H23F3N4O2
  • Average mass468.471 Da
  • Monoisotopic mass468.177307 Da
  • ChemSpider ID28189694

  • defined stereocentres - 1 of 1 defined stereocentres

More details:

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

2(1H)-Pyridinone, 5-(difluoromethyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-3-[[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]amino]- [ACD/Index Name]
5-(Difluormethyl)-1-[(1S)-1-(4-fluorphenyl)ethyl]-3-{[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]amino}-2(1H)-pyridinon [German] [ACD/IUPAC Name]
5-(Difluoromethyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-3-{[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]amino}-2(1H)-pyridinone [ACD/IUPAC Name]
5-(Difluorométhyl)-1-[(1S)-1-(4-fluorophényl)éthyl]-3-{[3-méthoxy-4-(4-méthyl-1H-imidazol-1-yl)phényl]amino}-2(1H)-pyridinone [French] [ACD/IUPAC Name]
(S)-5-(difluoromethyl)-1-(1-(4-fluorophenyl)ethyl)-3-((3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl)amino)pyridin-2(1H)-one
1128103-37-6 [RN]
2(1H)pyridinone,5-(difluoromethyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-3-[[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]amino]-
2(1H)-Pyridinone,5-(difluoromethyl)-1-[(1S)-1-(4-fluorophenyl)ethyl]-3-[[3-methoxy-4-(4-methyl-1H-imidazol-1-yl)phenyl]amino]-
5-(DIFLUOROMETHYL)-1-[(1S)-1-(4-FLUOROPHENYL)ETHYL]-3-[[3-METHOXY-4-(4-METHYL-1H-IMIDAZOL-1-YL)PHENYL]AMINO]-2(1H)PYRIDINONE
5-(DIFLUOROMETHYL)-1-[(1S)-1-(4-FLUOROPHENYL)ETHYL]-3-{[3-METHOXY-4-(4-METHYLIMIDAZOL-1-YL)PHENYL]AMINO}PYRIDIN-2-ONE

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

Density: 1.3±0.1 g/cm3
Boiling Point: 632.3±55.0 °C at 760 mmHg
Vapour Pressure: 0.0±1.9 mmHg at 25°C
Enthalpy of Vaporization: 93.5±3.0 kJ/mol
Flash Point: 336.2±31.5 °C
Index of Refraction: 1.595
Molar Refractivity: 122.9±0.5 cm3
#H bond acceptors: 6
#H bond donors: 1
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 0
ACD/LogP: 4.26
ACD/LogD (pH 5.5): 3.06
ACD/BCF (pH 5.5): 84.05
ACD/KOC (pH 5.5): 522.09
ACD/LogD (pH 7.4): 3.74
ACD/BCF (pH 7.4): 408.39
ACD/KOC (pH 7.4): 2536.86
Polar Surface Area: 59 Å2
Polarizability: 48.7±0.5 10-24cm3
Surface Tension: 40.4±7.0 dyne/cm
Molar Volume: 361.4±7.0 cm3

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