N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}propane-2-sulfonamide
Chemical Structure Depiction of
N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}propane-2-sulfonamide
N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}propane-2-sulfonamide
Compound characteristics
| Compound ID: | M070-1247 |
| Compound Name: | N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}propane-2-sulfonamide |
| Molecular Weight: | 344.51 |
| Molecular Formula: | C14 H20 N2 O2 S3 |
| Smiles: | CC(C)CSc1nc2ccc(cc2s1)NS(C(C)C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.8243 |
| logD: | 4.8188 |
| logSw: | -4.5543 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.241 |
| InChI Key: | QWFDOYGFZWMBLL-UHFFFAOYSA-N |