ethyl N-(4-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)-beta-alaninate
Chemical Structure Depiction of
ethyl N-(4-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)-beta-alaninate
ethyl N-(4-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)-beta-alaninate
Compound characteristics
| Compound ID: | G909-0156 |
| Compound Name: | ethyl N-(4-{4-[(4-methylphenyl)methyl]-2,3-dioxopiperazin-1-yl}piperidine-1-carbonyl)-beta-alaninate |
| Molecular Weight: | 444.53 |
| Molecular Formula: | C23 H32 N4 O5 |
| Smiles: | CCOC(CCNC(N1CCC(CC1)N1CCN(Cc2ccc(C)cc2)C(C1=O)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 1.7049 |
| logD: | 1.7049 |
| logSw: | -2.299 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.542 |
| InChI Key: | KXCXYEZEMVVHCC-UHFFFAOYSA-N |