diethyl 1,2,3-trimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
Chemical Structure Depiction of
diethyl 1,2,3-trimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
diethyl 1,2,3-trimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate
Compound characteristics
| Compound ID: | 8019-6779 |
| Compound Name: | diethyl 1,2,3-trimethyl-6-oxo-2,6-dihydrocyclohepta[c]pyrrole-5,7-dicarboxylate |
| Molecular Weight: | 331.37 |
| Molecular Formula: | C18 H21 N O5 |
| Smiles: | CCOC(C1=Cc2c(C=C(C1=O)C(=O)OCC)c(C)n(C)c2C)=O |
| Stereo: | ACHIRAL |
| logP: | 2.2784 |
| logD: | 2.2784 |
| logSw: | -1.9198 |
| Hydrogen bond acceptors count: | 8 |
| Polar surface area: | 57.923 |
| InChI Key: | KLUOBXIQWWWMSA-UHFFFAOYSA-N |