methyl 4-{[1-(2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[(4-methoxyphenyl)methyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-{[1-(2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[(4-methoxyphenyl)methyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-{[1-(2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[(4-methoxyphenyl)methyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 5752-2472 |
| Compound Name: | methyl 4-{[1-(2-fluorophenyl)-2,5-dimethyl-1H-pyrrol-3-yl]methylidene}-1-[(4-methoxyphenyl)methyl]-2-methyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 474.53 |
| Molecular Formula: | C28 H27 F N2 O4 |
| Smiles: | CC1=C(/C(=C/c2cc(C)n(c3ccccc3F)c2C)C(N1Cc1ccc(cc1)OC)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 4.5249 |
| logD: | 4.5249 |
| logSw: | -4.3365 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 47.018 |
| InChI Key: | CCXGPTTUQOMAFG-UHFFFAOYSA-N |