6,6-dimethyl-2-(4-methylphenyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Chemical Structure Depiction of
6,6-dimethyl-2-(4-methylphenyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
6,6-dimethyl-2-(4-methylphenyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Compound characteristics
| Compound ID: | L120-1041 |
| Compound Name: | 6,6-dimethyl-2-(4-methylphenyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-6,7-dihydroisoquinoline-3,8(2H,5H)-dione |
| Molecular Weight: | 470.57 |
| Molecular Formula: | C28 H30 N4 O3 |
| Smiles: | Cc1ccc(cc1)N1C=C2C(CC(C)(C)CC2=O)=C(C(N2CCN(CC2)c2ccccn2)=O)C1=O |
| Stereo: | ACHIRAL |
| logP: | 3.2714 |
| logD: | 3.2626 |
| logSw: | -3.2061 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.614 |
| InChI Key: | WPRCSVCSXORNQS-UHFFFAOYSA-N |