N-[(4-chlorophenyl)methyl]-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
Chemical Structure Depiction of
N-[(4-chlorophenyl)methyl]-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
N-[(4-chlorophenyl)methyl]-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
Compound characteristics
| Compound ID: | E022-1002 |
| Compound Name: | N-[(4-chlorophenyl)methyl]-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide |
| Molecular Weight: | 360.86 |
| Molecular Formula: | C18 H17 Cl N2 O2 S |
| Smiles: | CCC(C(NCc1ccc(cc1)[Cl])=O)N1C(c2ccccc2S1)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.7306 |
| logD: | 3.7306 |
| logSw: | -4.3919 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.798 |
| InChI Key: | NYHLTBJGJKIYSI-HNNXBMFYSA-N |