methyl 4-[3-(4-chlorobenzoyl)-4-hydroxy-1-(2-methylpropyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
Chemical Structure Depiction of
methyl 4-[3-(4-chlorobenzoyl)-4-hydroxy-1-(2-methylpropyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
methyl 4-[3-(4-chlorobenzoyl)-4-hydroxy-1-(2-methylpropyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate
Compound characteristics
| Compound ID: | 4622-8585 |
| Compound Name: | methyl 4-[3-(4-chlorobenzoyl)-4-hydroxy-1-(2-methylpropyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl]benzoate |
| Molecular Weight: | 427.88 |
| Molecular Formula: | C23 H22 Cl N O5 |
| Smiles: | CC(C)CN1C(C(=C(C1=O)O)C(c1ccc(cc1)[Cl])=O)c1ccc(cc1)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.6422 |
| logD: | 4.641 |
| logSw: | -4.8656 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 66.272 |
| InChI Key: | DRTWMMHUKOCOOK-LJQANCHMSA-N |