2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-N-(pyridin-3-yl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-N-(pyridin-3-yl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-N-(pyridin-3-yl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1564 |
| Compound Name: | 2-(4-chlorophenyl)-6,6-dimethyl-3,8-dioxo-N-(pyridin-3-yl)-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 421.88 |
| Molecular Formula: | C23 H20 Cl N3 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(Nc2cccnc2)=O)=O)c2ccc(cc2)[Cl])C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7756 |
| logD: | 2.7378 |
| logSw: | -3.4154 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.804 |
| InChI Key: | PYCKJBYRBLEACX-UHFFFAOYSA-N |