methyl 1-(3,4-dimethylphenyl)-5-({4-[2-(2-methoxyanilino)-2-oxoethoxy]phenyl}methylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 1-(3,4-dimethylphenyl)-5-({4-[2-(2-methoxyanilino)-2-oxoethoxy]phenyl}methylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 1-(3,4-dimethylphenyl)-5-({4-[2-(2-methoxyanilino)-2-oxoethoxy]phenyl}methylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-2806 |
| Compound Name: | methyl 1-(3,4-dimethylphenyl)-5-({4-[2-(2-methoxyanilino)-2-oxoethoxy]phenyl}methylidene)-2-methyl-4-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 526.59 |
| Molecular Formula: | C31 H30 N2 O6 |
| Smiles: | CC1=C(C(/C(=C/c2ccc(cc2)OCC(Nc2ccccc2OC)=O)N1c1ccc(C)c(C)c1)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 5.4686 |
| logD: | 5.3961 |
| logSw: | -5.46 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.721 |
| InChI Key: | OIMGSFGYOMXDSW-UHFFFAOYSA-N |