1-(4-chlorophenyl)-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}methanesulfonamide
Chemical Structure Depiction of
1-(4-chlorophenyl)-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}methanesulfonamide
1-(4-chlorophenyl)-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}methanesulfonamide
Compound characteristics
| Compound ID: | M070-2127 |
| Compound Name: | 1-(4-chlorophenyl)-N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}methanesulfonamide |
| Molecular Weight: | 412.98 |
| Molecular Formula: | C17 H17 Cl N2 O2 S3 |
| Smiles: | CC(C)Sc1nc2ccc(cc2s1)NS(Cc1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.5248 |
| logD: | 5.365 |
| logSw: | -6.0153 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 51.597 |
| InChI Key: | GDMVTZQAEUTXTE-UHFFFAOYSA-N |