2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-0946 |
| Compound Name: | 2-(4-fluorophenyl)-6,6-dimethyl-3,8-dioxo-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 439.53 |
| Molecular Formula: | C25 H30 F N3 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(NCCN2CCCCC2)=O)=O)c2ccc(cc2)F)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.1666 |
| logD: | 0.2537 |
| logSw: | -2.6901 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.432 |
| InChI Key: | WHVXZAHCDYRRMP-UHFFFAOYSA-N |