John Wiley & Sons, Inc. SpectraBase; SpectraBase Compound ID=11pLmePq2WJ

(accessed ).
(+)-2-(3,4-DICHLOROPHENYL)-1-[(R)-4-PHENYL-2-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-ETHAN-1-ONE;MAJOR-ROTAMER
SpectraBase Compound ID 11pLmePq2WJ
InChI InChI=1S/C24H29Cl2N3O/c1-18(27-11-5-6-12-27)23-17-28(20-7-3-2-4-8-20)13-14-29(23)24(30)16-19-9-10-21(25)22(26)15-19/h2-4,7-10,15,18,23H,5-6,11-14,16-17H2,1H3/t18-,23-/m0/s1
InChIKey OYRXYIUNONBFEX-MBSDFSHPSA-N
Mol Weight 446.42 g/mol
Molecular Formula C24H29Cl2N3O
Exact Mass 445.168768 g/mol
Enantiomer InChIKey OYRXYIUNONBFEX-WZONZLPQSA-N
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D5NO2
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D5NO2
Copyright Copyright © 2016-2020 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved.
Solvent C6D5NO2
  • (+)-2-(3,4-DICHLOROPHENYL)-1-[(R)-4-PHENYL-2-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-ETHAN-1-ONE;MINOR-ROTAMER
  • (+)-2-(3,4-DICHLOROPHENYL)-1-[(R)-4-PHENYL-2-[(S)-1-(PYRROLIDIN-1-YL)-ETHYL]-PIPERAZIN-1-YL]-ETHAN-1-ONE
Title Journal or Book Year
Methylated Analogues of Methyl (R)-4-(3,4-Dichlorophenylacetyl)- 3-(pyrrolidin-1-ylmethyl)piperazine-1-carboxylate (GR-89,696) as Highly Potent κ-Receptor Agonists:  Stereoselective Synthesis, Opioid-Receptor Affinity, Receptor Selectivity, and Functional Studies Journal of Medicinal Chemistry 2001
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