methyl 4-[(3-bromophenyl)methylidene]-1-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(3-bromophenyl)methylidene]-1-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(3-bromophenyl)methylidene]-1-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5618-4084 |
| Compound Name: | methyl 4-[(3-bromophenyl)methylidene]-1-(3,4-dimethoxyphenyl)-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 458.31 |
| Molecular Formula: | C22 H20 Br N O5 |
| Smiles: | CC1=C(/C(=C/c2cccc(c2)[Br])C(N1c1ccc(c(c1)OC)OC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.81 |
| logD: | 3.81 |
| logSw: | -4.0593 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 51.76 |
| InChI Key: | KRDVBZJJFQTIOV-UHFFFAOYSA-N |