4-([1,4'-bipiperidine]-1'-carbonyl)-2-(4-chlorophenyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Chemical Structure Depiction of
4-([1,4'-bipiperidine]-1'-carbonyl)-2-(4-chlorophenyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
4-([1,4'-bipiperidine]-1'-carbonyl)-2-(4-chlorophenyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Compound characteristics
| Compound ID: | L120-1546 |
| Compound Name: | 4-([1,4'-bipiperidine]-1'-carbonyl)-2-(4-chlorophenyl)-6,6-dimethyl-6,7-dihydroisoquinoline-3,8(2H,5H)-dione |
| Molecular Weight: | 496.05 |
| Molecular Formula: | C28 H34 Cl N3 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(N2CCC(CC2)N2CCCCC2)=O)=O)c2ccc(cc2)[Cl])C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4883 |
| logD: | 0.079 |
| logSw: | -3.7797 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 48.936 |
| InChI Key: | QULGDFAAQOTIEB-UHFFFAOYSA-N |