ethyl N-(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)-beta-alaninate
ethyl N-(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)-beta-alaninate
Compound characteristics
| Compound ID: | G909-0304 |
| Compound Name: | ethyl N-(4-{4-[(3-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)-beta-alaninate |
| Molecular Weight: | 448.49 |
| Molecular Formula: | C22 H29 F N4 O5 |
| Smiles: | CCOC(CCNC(N1CCC(CC1)N1CCN(Cc2cccc(c2)F)C(C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.4037 |
| logD: | 1.4037 |
| logSw: | -2.1503 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.542 |
| InChI Key: | GMEZRTAMZFYWOV-UHFFFAOYSA-N |