1-(3,5-difluorophenyl)-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}methanesulfonamide
Chemical Structure Depiction of
1-(3,5-difluorophenyl)-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}methanesulfonamide
1-(3,5-difluorophenyl)-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}methanesulfonamide
Compound characteristics
| Compound ID: | M070-1139 |
| Compound Name: | 1-(3,5-difluorophenyl)-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}methanesulfonamide |
| Molecular Weight: | 414.51 |
| Molecular Formula: | C17 H16 F2 N2 O2 S3 |
| Smiles: | CC(C)Sc1nc2ccc(cc2s1)NS(Cc1cc(cc(c1)F)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.6154 |
| logD: | 5.4556 |
| logSw: | -5.5005 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.597 |
| InChI Key: | BTMDTFMCRDUZGO-UHFFFAOYSA-N |