ethyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
ethyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
ethyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-0023 |
| Compound Name: | ethyl 4-{[4-(methoxycarbonyl)phenyl]methylidene}-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 371.43 |
| Molecular Formula: | C21 H25 N O5 |
| Smiles: | CCOC(C1/C(=C/c2ccc(cc2)C(=O)OC)C(N(CC(C)C)C=1C)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.148 |
| logD: | 4.148 |
| logSw: | -4.1465 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 58.136 |
| InChI Key: | ZRLTUVAHXOYKHS-UHFFFAOYSA-N |