N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}benzenesulfonamide
Chemical Structure Depiction of
N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}benzenesulfonamide
N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}benzenesulfonamide
Compound characteristics
| Compound ID: | M070-1065 |
| Compound Name: | N-{2-[(propan-2-yl)sulfanyl]-1,3-benzothiazol-6-yl}benzenesulfonamide |
| Molecular Weight: | 364.51 |
| Molecular Formula: | C16 H16 N2 O2 S3 |
| Smiles: | CC(C)Sc1nc2ccc(cc2s1)NS(c1ccccc1)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8453 |
| logD: | 4.7153 |
| logSw: | -4.6287 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.97 |
| InChI Key: | DFDBRMFTMGJJAV-UHFFFAOYSA-N |