N-[2-[(2R)-[(1S)-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYLETHYL]-5-OXOPIPERAZIN-1-YL]-ACETYL]-ORN(Z)-NH-BN
Compound with spectra: 1 NMR
![N-[2-[(2R)-[(1S)-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYLETHYL]-5-OXOPIPERAZIN-1-YL]-ACETYL]-ORN(Z)-NH-BN](/api/compound/JB6DwAtwXvD.png?ph=true&h=300&w=458 "N-[2-[(2R)-[(1S)-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYLETHYL]-5-OXOPIPERAZIN-1-YL]-ACETYL]-ORN(Z)-NH-BN")
| SpectraBase Compound ID | JB6DwAtwXvD |
|---|---|
| InChI | InChI=1S/C39H50N6O7/c1-39(2,3)52-38(50)44-32(22-28-14-7-4-8-15-28)33-24-41-34(46)25-45(33)26-35(47)43-31(36(48)42-23-29-16-9-5-10-17-29)20-13-21-40-37(49)51-27-30-18-11-6-12-19-30/h4-12,14-19,31-33H,13,20-27H2,1-3H3,(H,40,49)(H,41,46)(H,42,48)(H,43,47)(H,44,50)/t31?,32-,33+/m0/s1 |
| InChIKey | QLBBUWVOFLFTIK-ADIDXWPESA-N |
| Mol Weight | 714.9 g/mol |
| Molecular Formula | C39H50N6O7 |
| Exact Mass | 714.374098 g/mol |
| Enantiomer InChIKey | QLBBUWVOFLFTIK-GGRPWLMJSA-N |
| Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
|---|---|
| Solvent | CDCl3 |
N-[2-[(2S)-[(1S)-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYLETHYL]-5-OXOPIPERAZIN-1-YL]-ACETYL]-LYS(Z)-NH-BN
N-[2-[(2R)-[(1S)-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYLETHYL]-5-OXOPIPERAZIN-1-YL]-ACETYL]-LYS(Z)-NH-BN
N-[2-[(2S)-[(1S)-(3-BENZYLUREIDO)-2-PHENYLETHYL]-5-OXO-PIPERAZIN-1-YL]-ACETYL]-ORN(Z)-NH-BN
N-[2-[(2R)-[(1S)-(3-BENZYLUREIDO)-2-PHENYLETHYL]-5-OXO-PIPERAZIN-1-YL]-ACETYL]-LYS(Z)-NH-BN
N-[2-[5-OXO-(2S)-[2-PHENYL-(1S)-(3-PHENYLUREIDO)-ETHYL]-PIPERAZIN-1-YL]-ACETYL]-LYS-NH-BN-HYDROCHLORIDE
N-[2-[5-OXO-(2R)-[2-PHENYL-(1S)-(3-PHENYLUREIDO)-ETHYL]-PIPERAZIN-1-YL]-ACETYL]-LYS-NH-BN-HYDROCHLORIDE
N-[2-[4-BENZYL-(2S)-[(1S)-AMINO]-2-PHENYLETHYL]-5-OXO-PIPERAZIN-1-YL]-ACETYL]-ORN(Z)-NH-BN-HYDROCHLORIDE
N-[2-[4-BENZYL-(2R)-[(1S)-AMINO]-2-PHENYLETHYL]-5-OXO-PIPERAZIN-1-YL]-ACETYL]-LYS(Z)-NH-BN-HYDROCHLORIDE
2-[4-BENZYL-(2S)-[(1S)-[(TERT.-BUTOXYCARBONYL)-AMINO]-2-PHENYLETHYL]-5-OXO-PIPERAZIN-1-YL]-ACETIC-ACID
| Title | Journal or Book | Year |
|---|---|---|
| Exploring the Phe-Gly Dipeptide-Derived Piperazinone Scaffold in the Search for Antagonists of the Thrombin Receptor PAR1 | Molecules | 2014 |