N-{[3-(2-fluorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}isoleucine
Chemical Structure Depiction of
N-{[3-(2-fluorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}isoleucine
N-{[3-(2-fluorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}isoleucine
Compound characteristics
| Compound ID: | Y043-1286 |
| Compound Name: | N-{[3-(2-fluorophenyl)-6-oxopyridazin-1(6H)-yl]acetyl}isoleucine |
| Molecular Weight: | 361.37 |
| Molecular Formula: | C18 H20 F N3 O4 |
| Smiles: | CC[C@@H](C)[C@@H](C(O)=O)NC(CN1C(C=CC(c2ccccc2F)=N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.7226 |
| logD: | -2.9066 |
| logSw: | -2.251 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 81.051 |
| InChI Key: | JSNZFSOZHJIKPE-DIFFPNOSSA-N |