methyl 4-benzylidene-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Chemical Structure Depiction of
methyl 4-benzylidene-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
methyl 4-benzylidene-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate
Compound characteristics
| Compound ID: | 4031-1804 |
| Compound Name: | methyl 4-benzylidene-1,2-dimethyl-5-oxo-4,5-dihydro-1H-pyrrole-3-carboxylate |
| Molecular Weight: | 257.29 |
| Molecular Formula: | C15 H15 N O3 |
| Smiles: | CC1=C(/C(=C/c2ccccc2)C(N1C)=O)C(=O)OC |
| Stereo: | ACHIRAL |
| logP: | 2.0101 |
| logD: | 2.0101 |
| logSw: | -2.0454 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 37.148 |
| InChI Key: | SKCRBPPDXNWYCR-UHFFFAOYSA-N |