methyl N-{[3-(2-fluorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}-L-phenylalaninate
Chemical Structure Depiction of
methyl N-{[3-(2-fluorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}-L-phenylalaninate
methyl N-{[3-(2-fluorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}-L-phenylalaninate
Compound characteristics
| Compound ID: | Y041-5005 |
| Compound Name: | methyl N-{[3-(2-fluorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}-L-phenylalaninate |
| Molecular Weight: | 409.42 |
| Molecular Formula: | C22 H20 F N3 O4 |
| Smiles: | COC([C@H](Cc1ccccc1)NC(CN1C(C=CC(c2ccccc2F)=N1)=O)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 2.298 |
| logD: | 2.298 |
| logSw: | -3.014 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.823 |
| InChI Key: | CTCZLDULRMHGKG-IBGZPJMESA-N |