N-benzyl-2-(4-chlorophenyl)-N,6,6-trimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Chemical Structure Depiction of
N-benzyl-2-(4-chlorophenyl)-N,6,6-trimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
N-benzyl-2-(4-chlorophenyl)-N,6,6-trimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide
Compound characteristics
| Compound ID: | L120-1476 |
| Compound Name: | N-benzyl-2-(4-chlorophenyl)-N,6,6-trimethyl-3,8-dioxo-2,3,5,6,7,8-hexahydroisoquinoline-4-carboxamide |
| Molecular Weight: | 448.95 |
| Molecular Formula: | C26 H25 Cl N2 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(N(C)Cc2ccccc2)=O)=O)c2ccc(cc2)[Cl])C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.8777 |
| logD: | 3.8777 |
| logSw: | -4.3641 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 45.345 |
| InChI Key: | KMCXOSCUGPQYET-UHFFFAOYSA-N |