N-{[6-oxo-3-(thiophen-2-yl)pyridazin-1(6H)-yl]acetyl}isoleucine
Chemical Structure Depiction of
N-{[6-oxo-3-(thiophen-2-yl)pyridazin-1(6H)-yl]acetyl}isoleucine
N-{[6-oxo-3-(thiophen-2-yl)pyridazin-1(6H)-yl]acetyl}isoleucine
Compound characteristics
| Compound ID: | Y043-1258 |
| Compound Name: | N-{[6-oxo-3-(thiophen-2-yl)pyridazin-1(6H)-yl]acetyl}isoleucine |
| Molecular Weight: | 349.41 |
| Molecular Formula: | C16 H19 N3 O4 S |
| Smiles: | CC[C@@H](C)[C@@H](C(O)=O)NC(CN1C(C=CC(c2cccs2)=N1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 0.6379 |
| logD: | -2.9913 |
| logSw: | -2.1117 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.069 |
| InChI Key: | HMARZUXPCKWLQH-BMIGLBTASA-N |