methyl 4-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(1-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(1-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(1-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5752-2491 |
| Compound Name: | methyl 4-{[1-(4-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-2-methyl-5-oxo-1-(1-phenylethyl)-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 458.53 |
| Molecular Formula: | C28 H27 F N2 O3 |
| Smiles: | CC(c1ccccc1)N1C(C)=C(/C(=C/c2cc(C)n(c3ccc(cc3)F)c2C)C1=O)C(=O)OC |
| Stereo: | RACEMIC MIXTURE |
| logP: | 4.7902 |
| logD: | 4.7902 |
| logSw: | -4.7073 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.116 |
| InChI Key: | CDJGYNHCRMJCBG-SFHVURJKSA-N |