2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-N-[3-(trifluoromethyl)phenyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-N-[3-(trifluoromethyl)phenyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-N-[3-(trifluoromethyl)phenyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1458 |
| Compound Name: | 2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-N-[3-(trifluoromethyl)phenyl]-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 488.89 |
| Molecular Formula: | C25 H20 Cl F3 N2 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(Nc2cccc(c2)C(F)(F)F)=O)=O)c2ccc(cc2)[Cl])C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8954 |
| logD: | 3.8982 |
| logSw: | -5.0245 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.286 |
| InChI Key: | UWMHJAJGHPXBLH-UHFFFAOYSA-N |