methyl N-[(6-oxo-3-phenylpyridazin-1(6H)-yl)acetyl]-L-alaninate
Chemical Structure Depiction of
methyl N-[(6-oxo-3-phenylpyridazin-1(6H)-yl)acetyl]-L-alaninate
methyl N-[(6-oxo-3-phenylpyridazin-1(6H)-yl)acetyl]-L-alaninate
Compound characteristics
| Compound ID: | Y043-5040 |
| Compound Name: | methyl N-[(6-oxo-3-phenylpyridazin-1(6H)-yl)acetyl]-L-alaninate |
| Molecular Weight: | 315.33 |
| Molecular Formula: | C16 H17 N3 O4 |
| Smiles: | C[C@@H](C(=O)OC)NC(CN1C(C=CC(c2ccccc2)=N1)=O)=O |
| Stereo: | ABSOLUTE |
| logP: | 1.1172 |
| logD: | 1.1172 |
| logSw: | -2.0383 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.628 |
| InChI Key: | USHMHJXQIQYLRB-NSHDSACASA-N |