{4-[5-(3,4-dihydroisoquinolin-2(1H)-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(3-fluorophenyl)methanone
Chemical Structure Depiction of
{4-[5-(3,4-dihydroisoquinolin-2(1H)-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(3-fluorophenyl)methanone
{4-[5-(3,4-dihydroisoquinolin-2(1H)-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(3-fluorophenyl)methanone
Compound characteristics
| Compound ID: | 8016-9381 |
| Compound Name: | {4-[5-(3,4-dihydroisoquinolin-2(1H)-yl)-4-fluoro-2-nitrophenyl]piperazin-1-yl}(3-fluorophenyl)methanone |
| Molecular Weight: | 478.5 |
| Molecular Formula: | C26 H24 F2 N4 O3 |
| Smiles: | C1CN(Cc2ccccc12)c1cc(c(cc1F)[N+]([O-])=O)N1CCN(CC1)C(c1cccc(c1)F)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5696 |
| logD: | 4.5696 |
| logSw: | -4.5359 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 55.74 |
| InChI Key: | WRFANHGFSHYBAH-UHFFFAOYSA-N |