6,6-dimethyl-N-(3-methylbutyl)-3,8-dioxo-2-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
6,6-dimethyl-N-(3-methylbutyl)-3,8-dioxo-2-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
6,6-dimethyl-N-(3-methylbutyl)-3,8-dioxo-2-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1312 |
| Compound Name: | 6,6-dimethyl-N-(3-methylbutyl)-3,8-dioxo-2-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 380.49 |
| Molecular Formula: | C23 H28 N2 O3 |
| Smiles: | CC(C)CCNC(C1=C2CC(C)(C)CC(C2=CN(C1=O)c1ccccc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 2.8632 |
| logD: | 2.8629 |
| logSw: | -3.3586 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.721 |
| InChI Key: | IBTHGVNLAFQYIO-UHFFFAOYSA-N |