methyl 5-{[4-(2-anilino-2-oxoethoxy)phenyl]methylidene}-2-methyl-1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-{[4-(2-anilino-2-oxoethoxy)phenyl]methylidene}-2-methyl-1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 5-{[4-(2-anilino-2-oxoethoxy)phenyl]methylidene}-2-methyl-1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2805 |
| Compound Name: | methyl 5-{[4-(2-anilino-2-oxoethoxy)phenyl]methylidene}-2-methyl-1-(4-methylphenyl)-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 482.54 |
| Molecular Formula: | C29 H26 N2 O5 |
| Smiles: | CC1=C(C(/C(=C/c2ccc(cc2)OCC(Nc2ccccc2)=O)N1c1ccc(C)cc1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.8146 |
| logD: | 4.7489 |
| logSw: | -4.5794 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.788 |
| InChI Key: | BOABSLKXBBKUAQ-UHFFFAOYSA-N |