methyl 4-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-3-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Chemical Structure Depiction of
methyl 4-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-3-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
methyl 4-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-3-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate
Compound characteristics
| Compound ID: | F455-0485 |
| Compound Name: | methyl 4-{1-[2-(3,4-dimethoxyphenyl)ethyl]-4-hydroxy-3-(4-methylphenyl)-5-oxo-2,5-dihydro-1H-pyrrol-2-yl}benzoate |
| Molecular Weight: | 487.55 |
| Molecular Formula: | C29 H29 N O6 |
| Smiles: | Cc1ccc(cc1)C1C(c2ccc(cc2)C(=O)OC)N(CCc2ccc(c(c2)OC)OC)C(C=1O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.8213 |
| logD: | 4.8208 |
| logSw: | -4.4271 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.501 |
| InChI Key: | FMOHDNCMEUYWRP-SANMLTNESA-N |