ethyl 4-(2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetamido)benzoate
Chemical Structure Depiction of
ethyl 4-(2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetamido)benzoate
ethyl 4-(2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetamido)benzoate
Compound characteristics
| Compound ID: | F046-0485 |
| Compound Name: | ethyl 4-(2-{3-[4-(4-fluorophenyl)piperazin-1-yl]-6-oxopyridazin-1(6H)-yl}acetamido)benzoate |
| Molecular Weight: | 479.51 |
| Molecular Formula: | C25 H26 F N5 O4 |
| Smiles: | CCOC(c1ccc(cc1)NC(CN1C(C=CC(=N1)N1CCN(CC1)c1ccc(cc1)F)=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5305 |
| logD: | 3.5305 |
| logSw: | -3.5026 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.287 |
| InChI Key: | NQDYJCJYLODXTJ-UHFFFAOYSA-N |