methyl 5-{[3-(benzyloxy)phenyl]methylidene}-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-{[3-(benzyloxy)phenyl]methylidene}-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 5-{[3-(benzyloxy)phenyl]methylidene}-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5072-1365 |
| Compound Name: | methyl 5-{[3-(benzyloxy)phenyl]methylidene}-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 349.38 |
| Molecular Formula: | C21 H19 N O4 |
| Smiles: | CC1=C(C(/C(=C\c2cccc(c2)OCc2ccccc2)N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7512 |
| logD: | 3.6607 |
| logSw: | -4.0583 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.712 |
| InChI Key: | XMYRYESEMOVBQX-UHFFFAOYSA-N |