ethyl 5-[(3-bromophenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 5-[(3-bromophenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
ethyl 5-[(3-bromophenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5080-3400 |
| Compound Name: | ethyl 5-[(3-bromophenyl)methylidene]-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 336.18 |
| Molecular Formula: | C15 H14 Br N O3 |
| Smiles: | CCOC(C1=C(C)NC(=C\c2cccc(c2)[Br])\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7167 |
| logD: | 3.0147 |
| logSw: | -3.8413 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.064 |
| InChI Key: | BTLFOLYMBPNNNA-UHFFFAOYSA-N |