methyl 5-{[1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-fluorophenyl)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 5-{[1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-fluorophenyl)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 5-{[1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-fluorophenyl)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4693-1139 |
| Compound Name: | methyl 5-{[1-(2,4-dimethylphenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-(4-fluorophenyl)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 458.53 |
| Molecular Formula: | C28 H27 F N2 O3 |
| Smiles: | CC1=C(C(/C(=C/c2cc(C)n(c3ccc(C)cc3C)c2C)N1c1ccc(cc1)F)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.6887 |
| logD: | 5.6882 |
| logSw: | -5.4595 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.775 |
| InChI Key: | UWQVEGJSJZKEHM-UHFFFAOYSA-N |