methyl 4-{[2-(benzyloxy)phenyl]methylidene}-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-{[2-(benzyloxy)phenyl]methylidene}-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-{[2-(benzyloxy)phenyl]methylidene}-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5567-0005 |
| Compound Name: | methyl 4-{[2-(benzyloxy)phenyl]methylidene}-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 349.38 |
| Molecular Formula: | C21 H19 N O4 |
| Smiles: | CC1=C(/C(=C/c2ccccc2OCc2ccccc2)C(N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.7078 |
| logD: | 3.5878 |
| logSw: | -4.1258 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.35 |
| InChI Key: | IYIBEMCSMVSXOX-ATVHPVEESA-N |