methyl 4-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4257-1969 |
| Compound Name: | methyl 4-{[2,5-dimethyl-1-(4-methylphenyl)-1H-pyrrol-3-yl]methylidene}-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 364.44 |
| Molecular Formula: | C22 H24 N2 O3 |
| Smiles: | CC1=C(/C(=C/c2cc(C)n(c3ccc(C)cc3)c2C)C(N1C)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 3.1725 |
| logD: | 3.1725 |
| logSw: | -3.1529 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 39.812 |
| InChI Key: | NXHBRFWIOHBZFL-UHFFFAOYSA-N |