ethyl {1-[(4-bromo-2-methylphenoxy)acetyl]-3-oxopiperazin-2-yl}acetate
Chemical Structure Depiction of
ethyl {1-[(4-bromo-2-methylphenoxy)acetyl]-3-oxopiperazin-2-yl}acetate
ethyl {1-[(4-bromo-2-methylphenoxy)acetyl]-3-oxopiperazin-2-yl}acetate
Compound characteristics
| Compound ID: | D236-0008 |
| Compound Name: | ethyl {1-[(4-bromo-2-methylphenoxy)acetyl]-3-oxopiperazin-2-yl}acetate |
| Molecular Weight: | 413.27 |
| Molecular Formula: | C17 H21 Br N2 O5 |
| Smiles: | CCOC(CC1C(NCCN1C(COc1ccc(cc1C)[Br])=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 2.1261 |
| logD: | 2.1261 |
| logSw: | -2.8337 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.654 |
| InChI Key: | HRXUBYMASKBDIT-ZDUSSCGKSA-N |