3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-1(2H)-one
Chemical Structure Depiction of
3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-1(2H)-one
3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-1(2H)-one
Compound characteristics
| Compound ID: | C096-0781 |
| Compound Name: | 3-(4-fluorophenyl)-2-(2-methoxyethyl)-4-[4-(pyridin-2-yl)piperazine-1-carbonyl]-3,4-dihydroisoquinolin-1(2H)-one |
| Molecular Weight: | 488.56 |
| Molecular Formula: | C28 H29 F N4 O3 |
| Smiles: | COCCN1C(C(C(N2CCN(CC2)c2ccccn2)=O)c2ccccc2C1=O)c1ccc(cc1)F |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 3.5584 |
| logD: | 3.5496 |
| logSw: | -3.5922 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.664 |
| InChI Key: | IOKDZNOYDVMDRK-UHFFFAOYSA-N |