(3R,4R)-N-(4-Chlorophenyl)-N'-[2-Fluoro-4-(2-Oxo-1(2H)-Pyridinyl)Phenyl]-1-[2-(Methylamino)-2-Oxoethyl]-3,4-Pyrrolidinedicarboxamide

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Properties Simple | Detailed

Formula C26H25ClFN5O4+
IUPAC Name (1s,3r,4r)-n4-(4-chlorophenyl)-n3-[2-fluoro-4-(2-oxo-1-pyridyl)phenyl]-1-[2-(methylamino)-2-oxo-ethyl]pyrrolidine-3,4-dicarboxamide
Molecular Mass 525.959 g·mol−1
Heat of Formation -599.7 ± 16.7 kJ·mol−1
Dipole Moment 5.80 ± 1.08 D
Volume 593.09 Å 3
Surface Area 520.94 Å 2
HOMO Energy -9.13 ± 0.55 eV
LUMO Energy -0.73 ± eV
Point Group Symmetry C1
Synonyms
  • (3r,4r)-n'-(4-chlorophenyl)-n-[2-fluoro-4-(2-keto-1-pyridyl)phenyl]-1-(2-keto-2-methylamino-ethyl)pyrrolidine-3,4-dicarboxamide
  • (3r,4r)-n'-(4-chlorophenyl)-n-[2-fluoro-4-(2-oxo-1-pyridyl)phenyl]-1-(2-methylamino-2-oxo-ethyl)pyrrolidine-3,4-dicarboxamide
  • (3r,4r)-n'-(4-chlorophenyl)-n-[2-fluoro-4-(2-oxo-1-pyridyl)phenyl]-1-(2-methylamino-2-oxoethyl)pyrrolidine-3,4-dicarboxamide
  • (3r,4r)-n'-(4-chlorophenyl)-n-[2-fluoro-4-(2-oxopyridin-1-yl)phenyl]-1-(2-methylamino-2-oxo-ethyl)pyrrolidine-3,4-dicarboxamide
InChIKey DXHIEYAKKGEXDY-PMACEKPBSA-N
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Elements C Cl H F O N