N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide
Chemical Structure Depiction of
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide
N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide
Compound characteristics
| Compound ID: | E022-0880 |
| Compound Name: | N-{2-[4-(methylsulfanyl)phenyl]ethyl}-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide |
| Molecular Weight: | 372.51 |
| Molecular Formula: | C19 H20 N2 O2 S2 |
| Smiles: | CC(C(NCCc1ccc(cc1)SC)=O)N1C(c2ccccc2S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.2716 |
| logD: | 3.2716 |
| logSw: | -3.6969 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.055 |
| InChI Key: | DCDOEFIPIQJGFL-ZDUSSCGKSA-N |