diethyl 1,3-dimethyl-2-(4-methylphenyl)-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
Chemical Structure Depiction of
diethyl 1,3-dimethyl-2-(4-methylphenyl)-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
diethyl 1,3-dimethyl-2-(4-methylphenyl)-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
Compound characteristics
| Compound ID: | D719-0006 |
| Compound Name: | diethyl 1,3-dimethyl-2-(4-methylphenyl)-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate |
| Molecular Weight: | 407.47 |
| Molecular Formula: | C24 H25 N O5 |
| Smiles: | CCOC(C1=Cc2c(C=C(C1=O)C(=O)OCC)c(C)n(c1ccc(C)cc1)c2C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2745 |
| logD: | 4.2745 |
| logSw: | -4.2311 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.585 |
| InChI Key: | JHFDQBPPWKAWBQ-UHFFFAOYSA-N |