ethyl N-({5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetyl)phenylalaninate
Chemical Structure Depiction of
ethyl N-({5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetyl)phenylalaninate
ethyl N-({5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetyl)phenylalaninate
Compound characteristics
| Compound ID: | 8014-2732 |
| Compound Name: | ethyl N-({5-[4-(methylsulfanyl)phenyl]-2H-tetrazol-2-yl}acetyl)phenylalaninate |
| Molecular Weight: | 425.51 |
| Molecular Formula: | C21 H23 N5 O3 S |
| Smiles: | CCOC(C(Cc1ccccc1)NC(Cn1nc(c2ccc(cc2)SC)nn1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.3597 |
| logD: | 3.3597 |
| logSw: | -3.4928 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 83.197 |
| InChI Key: | YDNQXIPKFRXTGC-SFHVURJKSA-N |