methyl 3-{3-[(4-bromophenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}benzoate
Chemical Structure Depiction of
methyl 3-{3-[(4-bromophenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}benzoate
methyl 3-{3-[(4-bromophenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}benzoate
Compound characteristics
| Compound ID: | 8007-4561 |
| Compound Name: | methyl 3-{3-[(4-bromophenyl)methylidene]-2-oxo-5-phenyl-2,3-dihydro-1H-pyrrol-1-yl}benzoate |
| Molecular Weight: | 460.33 |
| Molecular Formula: | C25 H18 Br N O3 |
| Smiles: | COC(c1cccc(c1)N1C(=C/C(=C\c2ccc(cc2)[Br])C1=O)c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.0759 |
| logD: | 6.0759 |
| logSw: | -5.6564 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 36.221 |
| InChI Key: | ALELWXCCPCDDGZ-UHFFFAOYSA-N |