ethyl 4-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)benzoate
Chemical Structure Depiction of
ethyl 4-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)benzoate
ethyl 4-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)benzoate
Compound characteristics
| Compound ID: | 6557-0076 |
| Compound Name: | ethyl 4-(8-ethoxy-1,3-dimethyl-4-oxocyclohepta[c]pyrrol-2(4H)-yl)benzoate |
| Molecular Weight: | 365.43 |
| Molecular Formula: | C22 H23 N O4 |
| Smiles: | CCOC1=CC=CC(c2c1c(C)n(c1ccc(cc1)C(=O)OCC)c2C)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3771 |
| logD: | 4.3771 |
| logSw: | -4.4113 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 43.747 |
| InChI Key: | AEOPCSPQTFPYAZ-UHFFFAOYSA-N |