2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-(4-fluoro-2-methoxyphenyl)pyridazin-3(2H)-one
Chemical Structure Depiction of
2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-(4-fluoro-2-methoxyphenyl)pyridazin-3(2H)-one
2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-(4-fluoro-2-methoxyphenyl)pyridazin-3(2H)-one
Compound characteristics
| Compound ID: | Y041-0266 |
| Compound Name: | 2-[2-(3,4-dihydroisoquinolin-2(1H)-yl)-2-oxoethyl]-6-(4-fluoro-2-methoxyphenyl)pyridazin-3(2H)-one |
| Molecular Weight: | 393.42 |
| Molecular Formula: | C22 H20 F N3 O3 |
| Smiles: | COc1cc(ccc1C1C=CC(N(CC(N2CCc3ccccc3C2)=O)N=1)=O)F |
| Stereo: | ACHIRAL |
| logP: | 3.0248 |
| logD: | 3.0248 |
| logSw: | -3.2999 |
| Hydrogen bond acceptors count: | 6 |
| Polar surface area: | 52.232 |
| InChI Key: | JQXVEPOHGSRJMS-UHFFFAOYSA-N |