2-(4-chlorophenyl)-N-(2,5-difluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-chlorophenyl)-N-(2,5-difluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
2-(4-chlorophenyl)-N-(2,5-difluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1587 |
| Compound Name: | 2-(4-chlorophenyl)-N-(2,5-difluorophenyl)-6,6-dimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 456.88 |
| Molecular Formula: | C24 H19 Cl F2 N2 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(Nc2cc(ccc2F)F)=O)=O)c2ccc(cc2)[Cl])C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2176 |
| logD: | 1.9061 |
| logSw: | -4.5775 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.588 |
| InChI Key: | FRYWVHQEQIEAHX-UHFFFAOYSA-N |