methyl 2-methyl-5-[(naphthalen-1-yl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-5-[(naphthalen-1-yl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 2-methyl-5-[(naphthalen-1-yl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-0406 |
| Compound Name: | methyl 2-methyl-5-[(naphthalen-1-yl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 293.32 |
| Molecular Formula: | C18 H15 N O3 |
| Smiles: | CC1=C(C(/C(=C\c2cccc3ccccc23)N1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.5013 |
| logD: | 3.3746 |
| logSw: | -3.6399 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 45.213 |
| InChI Key: | NTLWTBCZORYJPX-UHFFFAOYSA-N |