N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2-methoxy-4-(methylsulfanyl)benzamide
Chemical Structure Depiction of
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2-methoxy-4-(methylsulfanyl)benzamide
N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2-methoxy-4-(methylsulfanyl)benzamide
Compound characteristics
| Compound ID: | 4100-4454 |
| Compound Name: | N-[6-(methanesulfonyl)-1,3-benzothiazol-2-yl]-2-methoxy-4-(methylsulfanyl)benzamide |
| Molecular Weight: | 408.52 |
| Molecular Formula: | C17 H16 N2 O4 S3 |
| Smiles: | COc1cc(ccc1C(Nc1nc2ccc(cc2s1)S(C)(=O)=O)=O)SC |
| Stereo: | ACHIRAL |
| logP: | 3.1869 |
| logD: | 3.1156 |
| logSw: | -3.7183 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 70.47 |
| InChI Key: | VUJQOMJCUZGRGH-UHFFFAOYSA-N |