3-[2-(4-bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one
Chemical Structure Depiction of
3-[2-(4-bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one
3-[2-(4-bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one
Compound characteristics
| Compound ID: | 6047-0073 |
| Compound Name: | 3-[2-(4-bromophenyl)-2-oxoethylidene]-6-methylpiperazin-2-one |
| Molecular Weight: | 309.16 |
| Molecular Formula: | C13 H13 Br N2 O2 |
| Smiles: | CC1CNC(=C\C(c2ccc(cc2)[Br])=O)\C(N1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.9327 |
| logD: | 1.9272 |
| logSw: | -2.3727 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 49.729 |
| InChI Key: | YTHXNNJEVHNHEK-MRVPVSSYSA-N |