6,6-dimethyl-3,8-dioxo-2-phenyl-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,6-dimethyl-3,8-dioxo-2-phenyl-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
6,6-dimethyl-3,8-dioxo-2-phenyl-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1398 |
| Compound Name: | 6,6-dimethyl-3,8-dioxo-2-phenyl-N-[2-(piperidin-1-yl)ethyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 421.54 |
| Molecular Formula: | C25 H31 N3 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(NCCN2CCCCC2)=O)=O)c2ccccc2)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.016 |
| logD: | 0.1031 |
| logSw: | -2.405 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.432 |
| InChI Key: | IRHGUZBZUQSUBM-UHFFFAOYSA-N |