ethyl 4-(2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamido)benzoate
ethyl 4-(2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | F512-0657 |
| Compound Name: | ethyl 4-(2-{4-[(4-fluorophenyl)methyl]-2,3-dioxopiperazin-1-yl}acetamido)benzoate |
| Molecular Weight: | 427.43 |
| Molecular Formula: | C22 H22 F N3 O5 |
| Smiles: | [H]C(C(Nc1ccc(cc1)C(=O)OCC)=O)N1CCN(Cc2ccc(cc2)F)C(C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4712 |
| logD: | 2.4711 |
| logSw: | -2.8269 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 77.186 |
| InChI Key: | HYGORZOBWNUVHN-UHFFFAOYSA-N |