6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-N-(pyridin-3-yl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-N-(pyridin-3-yl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-N-(pyridin-3-yl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1117 |
| Compound Name: | 6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-N-(pyridin-3-yl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 401.46 |
| Molecular Formula: | C24 H23 N3 O3 |
| Smiles: | Cc1ccc(cc1)N1C=C2C(CC(C)(C)CC2=O)=C(C(Nc2cccnc2)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 2.6043 |
| logD: | 2.5665 |
| logSw: | -2.5206 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.804 |
| InChI Key: | GEMVKQWMGVHJDP-UHFFFAOYSA-N |