ethyl 1-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonyl]piperidine-4-carboxylate
Chemical Structure Depiction of
ethyl 1-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonyl]piperidine-4-carboxylate
ethyl 1-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonyl]piperidine-4-carboxylate
Compound characteristics
| Compound ID: | L120-0802 |
| Compound Name: | ethyl 1-[2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carbonyl]piperidine-4-carboxylate |
| Molecular Weight: | 468.52 |
| Molecular Formula: | C26 H29 F N2 O5 |
| Smiles: | CCOC(C1CCN(CC1)C(C1=C2CC(C)(C)CC(C2=CN(C1=O)c1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4868 |
| logD: | 2.4868 |
| logSw: | -2.3638 |
| Hydrogen bond acceptors count: | 9 |
| Polar surface area: | 66.596 |
| InChI Key: | CGTPXYXDZKXEMO-UHFFFAOYSA-N |