methyl 1-(4-chlorophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(4-chlorophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 1-(4-chlorophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2398 |
| Compound Name: | methyl 1-(4-chlorophenyl)-4-[(4-hydroxy-3-methoxyphenyl)methylidene]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 399.83 |
| Molecular Formula: | C21 H18 Cl N O5 |
| Smiles: | CC1=C(/C(=C/c2ccc(c(c2)OC)O)C(N1c1ccc(cc1)[Cl])=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1465 |
| logD: | 3.1416 |
| logSw: | -3.4489 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.677 |
| InChI Key: | DTJNVQIJGTVLNT-UHFFFAOYSA-N |