2,5-dimethoxy-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}benzene-1-sulfonamide
Chemical Structure Depiction of
2,5-dimethoxy-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}benzene-1-sulfonamide
2,5-dimethoxy-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-1082 |
| Compound Name: | 2,5-dimethoxy-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}benzene-1-sulfonamide |
| Molecular Weight: | 424.56 |
| Molecular Formula: | C18 H20 N2 O4 S3 |
| Smiles: | CC(C)Sc1nc2ccc(cc2s1)NS(c1cc(ccc1OC)OC)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8567 |
| logD: | 4.8115 |
| logSw: | -4.7218 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 65.144 |
| InChI Key: | OVBWUPDEZUKSBR-UHFFFAOYSA-N |