N-{[3-(furan-2-yl)-6-oxopyridazin-1(6H)-yl]acetyl}isoleucine
Chemical Structure Depiction of
N-{[3-(furan-2-yl)-6-oxopyridazin-1(6H)-yl]acetyl}isoleucine
N-{[3-(furan-2-yl)-6-oxopyridazin-1(6H)-yl]acetyl}isoleucine
Compound characteristics
| Compound ID: | Y044-1771 |
| Compound Name: | N-{[3-(furan-2-yl)-6-oxopyridazin-1(6H)-yl]acetyl}isoleucine |
| Molecular Weight: | 333.34 |
| Molecular Formula: | C16 H19 N3 O5 |
| Smiles: | CC[C@@H](C)[C@@H](C(O)=O)NC(CN1C(C=CC(c2ccco2)=N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | -0.1 |
| logD: | -3.7292 |
| logSw: | -1.6482 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 89.629 |
| InChI Key: | BBBVXZXLSIMQOB-BMIGLBTASA-N |