methyl 2-methyl-1-[(4-methylphenyl)methyl]-4-[(3-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 2-methyl-1-[(4-methylphenyl)methyl]-4-[(3-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 2-methyl-1-[(4-methylphenyl)methyl]-4-[(3-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2757 |
| Compound Name: | methyl 2-methyl-1-[(4-methylphenyl)methyl]-4-[(3-nitrophenyl)methylidene]-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 392.41 |
| Molecular Formula: | C22 H20 N2 O5 |
| Smiles: | CC1=C(/C(=C/c2cccc(c2)[N+]([O-])=O)C(N1Cc1ccc(C)cc1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.0775 |
| logD: | 4.0775 |
| logSw: | -4.3017 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 70.492 |
| InChI Key: | LUNJBLOQCQYZFS-UHFFFAOYSA-N |