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Search term: BGECSWGTDIXGJY (Found by InChIKey (skeleton match))

ChemSpider 2D Image | (2r,4s)-N^1^-(4-Chlorophenyl)-4-(2,4-Difluorophenyl)-4-Hydroxy-N^2^-(2-Oxo-2h-1,3'-Bipyridin-6'-Yl)pyrrolidine-1,2-Dicarboxamide | C28H22ClF2N5O4

(2r,4s)-N^1^-(4-Chlorophenyl)-4-(2,4-Difluorophenyl)-4-Hydroxy-N^2^-(2-Oxo-2h-1,3'-Bipyridin-6'-Yl)pyrrolidine-1,2-Dicarboxamide

  • Molecular FormulaC28H22ClF2N5O4
  • Average mass565.955 Da
  • Monoisotopic mass565.132813 Da
  • ChemSpider ID24697043
  • defined stereocentres - 2 of 2 defined stereocentres


More details:






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

(2r,4s)-N^1^-(4-Chlorophenyl)-4-(2,4-Difluorophenyl)-4-Hydroxy-N^2^-(2-Oxo-2h-1,3'-Bipyridin-6'-Yl)pyrrolidine-1,2-Dicarboxamide
(2R,4S)-N1-(4-Chlorophenyl)-4-(2,4-difluorophenyl)-4-hydroxy-N2-(2-oxo-2H-1,3'-bipyridin-6'-yl)-1,2-pyrrolidinedicarboxamide [ACD/IUPAC Name]
(2R,4S)-N1-(4-Chlorophényl)-4-(2,4-difluorophényl)-4-hydroxy-N2-(2-oxo-2H-1,3'-bipyridin-6'-yl)-1,2-pyrrolidinedicarboxamide [French] [ACD/IUPAC Name]
(2R,4S)-N1-(4-Chlorphenyl)-4-(2,4-difluorphenyl)-4-hydroxy-N2-(2-oxo-2H-1,3'-bipyridin-6'-yl)-1,2-pyrrolidindicarboxamid [German] [ACD/IUPAC Name]
1,2-Pyrrolidinedicarboxamide, N1-(4-chlorophenyl)-4-(2,4-difluorophenyl)-4-hydroxy-N2-(2-oxo[1(2H),3'-bipyridin]-6'-yl)-, (2R,4S)- [ACD/Index Name]
(2R,4S)-N1-(4-Chlorophenyl)-4-(2,4-difluorophenyl)-4-hydroxy-N2-(5-(2-oxopyridin-1(2H)-yl)pyridin-2-yl)pyrrolidine-1,2-dicarboxamide
L1C

Predicted data is generated using the ACD/Labs Percepta Platform - PhysChem Module

Density: 1.5±0.1 g/cm3
Boiling Point: 880.1±65.0 °C at 760 mmHg
Vapour Pressure: 0.0±0.3 mmHg at 25°C
Enthalpy of Vaporization: 134.0±3.0 kJ/mol
Flash Point: 486.1±34.3 °C
Index of Refraction: 1.708
Molar Refractivity: 142.6±0.3 cm3
#H bond acceptors: 9
#H bond donors: 3
#Freely Rotating Bonds: 5
#Rule of 5 Violations: 1
ACD/LogP: 1.87
ACD/LogD (pH 5.5): 2.26
ACD/BCF (pH 5.5): 30.44
ACD/KOC (pH 5.5): 401.29
ACD/LogD (pH 7.4): 2.26
ACD/BCF (pH 7.4): 30.45
ACD/KOC (pH 7.4): 401.34
Polar Surface Area: 115 Å2
Polarizability: 56.5±0.5 10-24cm3
Surface Tension: 79.0±3.0 dyne/cm
Molar Volume: 365.5±3.0 cm3

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