2-ethyl-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1,4-dihydroisoquinolin-3(2H)-one
Chemical Structure Depiction of
2-ethyl-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1,4-dihydroisoquinolin-3(2H)-one
2-ethyl-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1,4-dihydroisoquinolin-3(2H)-one
Compound characteristics
| Compound ID: | M575-0068 |
| Compound Name: | 2-ethyl-1-[4-(2-fluorophenyl)piperazine-1-carbonyl]-1,4-dihydroisoquinolin-3(2H)-one |
| Molecular Weight: | 381.45 |
| Molecular Formula: | C22 H24 F N3 O2 |
| Smiles: | CCN1C(C(N2CCN(CC2)c2ccccc2F)=O)c2ccccc2CC1=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.0674 |
| logD: | 3.0674 |
| logSw: | -3.2492 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 35.804 |
| InChI Key: | WFODHNMNUKJEAJ-OAQYLSRUSA-N |