6,6-dimethyl-2-phenyl-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Chemical Structure Depiction of
6,6-dimethyl-2-phenyl-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
6,6-dimethyl-2-phenyl-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-6,7-dihydroisoquinoline-3,8(2H,5H)-dione
Compound characteristics
| Compound ID: | L120-1267 |
| Compound Name: | 6,6-dimethyl-2-phenyl-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-6,7-dihydroisoquinoline-3,8(2H,5H)-dione |
| Molecular Weight: | 456.54 |
| Molecular Formula: | C27 H28 N4 O3 |
| Smiles: | CC1(C)CC2C(=CN(C(C=2C(N2CCN(CC2)c2ccccn2)=O)=O)c2ccccc2)C(C1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.7265 |
| logD: | 2.7176 |
| logSw: | -2.858 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 57.614 |
| InChI Key: | CENQCVAFIDQRNA-UHFFFAOYSA-N |