N-(2,5-difluorophenyl)-6,6-dimethyl-3,8-dioxo-2-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-(2,5-difluorophenyl)-6,6-dimethyl-3,8-dioxo-2-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
N-(2,5-difluorophenyl)-6,6-dimethyl-3,8-dioxo-2-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1371 |
| Compound Name: | N-(2,5-difluorophenyl)-6,6-dimethyl-3,8-dioxo-2-phenyl-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 422.43 |
| Molecular Formula: | C24 H20 F2 N2 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(Nc2cc(ccc2F)F)=O)=O)c2ccccc2)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5014 |
| logD: | 1.1898 |
| logSw: | -3.8553 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.588 |
| InChI Key: | JIEQPDWPCFFJOH-UHFFFAOYSA-N |