1-(4-bromo-3-methylphenyl)-5-oxopyrrolidine-3-carboxylic acid
Chemical Structure Depiction of
1-(4-bromo-3-methylphenyl)-5-oxopyrrolidine-3-carboxylic acid
1-(4-bromo-3-methylphenyl)-5-oxopyrrolidine-3-carboxylic acid
Compound characteristics
| Compound ID: | 8011-1271 |
| Compound Name: | 1-(4-bromo-3-methylphenyl)-5-oxopyrrolidine-3-carboxylic acid |
| Molecular Weight: | 298.13 |
| Molecular Formula: | C12 H12 Br N O3 |
| Smiles: | Cc1cc(ccc1[Br])N1CC(CC1=O)C(O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 1.7621 |
| logD: | -0.5983 |
| logSw: | -2.0276 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.396 |
| InChI Key: | CBCCVTRFEBPUAH-MRVPVSSYSA-N |