3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-[3-(methylsulfanyl)phenyl]propanamide
Chemical Structure Depiction of
3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-[3-(methylsulfanyl)phenyl]propanamide
3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-[3-(methylsulfanyl)phenyl]propanamide
Compound characteristics
| Compound ID: | E557-3249 |
| Compound Name: | 3-(2-methyl-1,3-benzothiazole-6-sulfonyl)-N-[3-(methylsulfanyl)phenyl]propanamide |
| Molecular Weight: | 406.54 |
| Molecular Formula: | C18 H18 N2 O3 S3 |
| Smiles: | Cc1nc2ccc(cc2s1)S(CCC(Nc1cccc(c1)SC)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2687 |
| logD: | 3.2687 |
| logSw: | -3.5605 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 61.679 |
| InChI Key: | QTHIKWVLAQAUTO-UHFFFAOYSA-N |