N-[(4-ethoxyphenyl)methyl]-6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-[(4-ethoxyphenyl)methyl]-6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
N-[(4-ethoxyphenyl)methyl]-6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1203 |
| Compound Name: | N-[(4-ethoxyphenyl)methyl]-6,6-dimethyl-2-(4-methylphenyl)-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 458.56 |
| Molecular Formula: | C28 H30 N2 O4 |
| Smiles: | CCOc1ccc(CNC(C2=C3CC(C)(C)CC(C3=CN(C2=O)c2ccc(C)cc2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 3.7507 |
| logD: | 3.7502 |
| logSw: | -4.0666 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 60.731 |
| InChI Key: | LYQPZDDJHRGWBG-UHFFFAOYSA-N |