methyl 4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-0316 |
| Compound Name: | methyl 4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-1-(2-methylpropyl)-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 345.39 |
| Molecular Formula: | C19 H23 N O5 |
| Smiles: | CC(C)CN1C(C)=C(/C(=C/c2ccc(c(c2)OC)O)C1=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.6667 |
| logD: | 2.6619 |
| logSw: | -2.6658 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.56 |
| InChI Key: | DHCBDOHXKHPWGC-UHFFFAOYSA-N |