ethyl 2-methyl-5-[(3-nitrophenyl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 2-methyl-5-[(3-nitrophenyl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
ethyl 2-methyl-5-[(3-nitrophenyl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2963 |
| Compound Name: | ethyl 2-methyl-5-[(3-nitrophenyl)methylidene]-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 302.28 |
| Molecular Formula: | C15 H14 N2 O5 |
| Smiles: | CCOC(C1=C(C)NC(=C/c2cccc(c2)[N+]([O-])=O)\C1=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7428 |
| logD: | 2.5149 |
| logSw: | -3.0478 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 78.446 |
| InChI Key: | SAVDWZBTNLVTRN-UHFFFAOYSA-N |