6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1167 |
| Compound Name: | 6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 435.57 |
| Molecular Formula: | C26 H33 N3 O3 |
| Smiles: | Cc1ccc(cc1)N1C=C2C(CC(C)(C)CC2=O)=C(C(NCCN2CCCCC2)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.561 |
| logD: | 0.648 |
| logSw: | -2.8718 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.432 |
| InChI Key: | KMSRBATTWBTFKN-UHFFFAOYSA-N |