N,6,6-trimethyl-N-(3-methylphenyl)-2-(4-methylphenyl)-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N,6,6-trimethyl-N-(3-methylphenyl)-2-(4-methylphenyl)-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
N,6,6-trimethyl-N-(3-methylphenyl)-2-(4-methylphenyl)-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1081 |
| Compound Name: | N,6,6-trimethyl-N-(3-methylphenyl)-2-(4-methylphenyl)-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 428.53 |
| Molecular Formula: | C27 H28 N2 O3 |
| Smiles: | Cc1ccc(cc1)N1C=C2C(CC(C)(C)CC2=O)=C(C(N(C)c2cccc(C)c2)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 4.055 |
| logD: | 4.055 |
| logSw: | -4.1923 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 44.563 |
| InChI Key: | XWAIBDGOHGRFMT-UHFFFAOYSA-N |