N-[(4-methylphenyl)methyl]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
Chemical Structure Depiction of
N-[(4-methylphenyl)methyl]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
N-[(4-methylphenyl)methyl]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
Compound characteristics
| Compound ID: | E022-1331 |
| Compound Name: | N-[(4-methylphenyl)methyl]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide |
| Molecular Weight: | 340.44 |
| Molecular Formula: | C19 H20 N2 O2 S |
| Smiles: | Cc1ccc(CNC(CCCN2C(c3ccccc3S2)=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.3791 |
| logD: | 2.3791 |
| logSw: | -2.908 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 42.077 |
| InChI Key: | RQNFRYILTFMCDG-UHFFFAOYSA-N |