ChemSpider 2D Image | (3R,4R)-N-(5-Chloro-2-pyridinyl)-1-(ethylsulfonyl)-N'-[2-fluoro-4-(2-oxo-1(2H)-pyridinyl)phenyl]-3,4-pyrrolidinedicarboxamide | C24H23ClFN5O5S

(3R,4R)-N-(5-Chloro-2-pyridinyl)-1-(ethylsulfonyl)-N'-[2-fluoro-4-(2-oxo-1(2H)-pyridinyl)phenyl]-3,4-pyrrolidinedicarboxamide

  • Molecular FormulaC24H23ClFN5O5S
  • Average mass547.986 Da
  • Monoisotopic mass547.109253 Da
  • ChemSpider ID25051758

  • defined stereocentres - 2 of 2 defined stereocentres

More details:

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

(3R,4R)-N-(5-Chlor-2-pyridinyl)-1-(ethylsulfonyl)-N'-[2-fluor-4-(2-oxo-1(2H)-pyridinyl)phenyl]-3,4-pyrrolidindicarboxamid [German] [ACD/IUPAC Name]
(3R,4R)-N-(5-Chloro-2-pyridinyl)-1-(ethylsulfonyl)-N'-[2-fluoro-4-(2-oxo-1(2H)-pyridinyl)phenyl]-3,4-pyrrolidinedicarboxamide [ACD/IUPAC Name]
(3R,4R)-N-(5-Chloro-2-pyridinyl)-1-(éthylsulfonyl)-N'-[2-fluoro-4-(2-oxo-1(2H)-pyridinyl)phényl]-3,4-pyrrolidinedicarboxamide [French] [ACD/IUPAC Name]
3,4-Pyrrolidinedicarboxamide, N3-(5-chloro-2-pyridinyl)-1-(ethylsulfonyl)-N4-[2-fluoro-4-(2-oxo-1(2H)-pyridinyl)phenyl]-, (3R,4R)- [ACD/Index Name]

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

Density: 1.5±0.1 g/cm3
Boiling Point:
Vapour Pressure:
Enthalpy of Vaporization:
Flash Point:
Index of Refraction: 1.676
Molar Refractivity: 134.3±0.4 cm3
#H bond acceptors: 10
#H bond donors: 2
#Freely Rotating Bonds: 7
#Rule of 5 Violations: 2
ACD/LogP: 1.75
ACD/LogD (pH 5.5): 1.36
ACD/BCF (pH 5.5): 6.35
ACD/KOC (pH 5.5): 130.65
ACD/LogD (pH 7.4): 1.36
ACD/BCF (pH 7.4): 6.35
ACD/KOC (pH 7.4): 130.67
Polar Surface Area: 137 Å2
Polarizability: 53.3±0.5 10-24cm3
Surface Tension: 75.6±5.0 dyne/cm
Molar Volume: 357.2±5.0 cm3

Click to predict properties on the Chemicalize site


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