3,5-dimethyl-N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}-1,2-oxazole-4-sulfonamide
Chemical Structure Depiction of
3,5-dimethyl-N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}-1,2-oxazole-4-sulfonamide
3,5-dimethyl-N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}-1,2-oxazole-4-sulfonamide
Compound characteristics
| Compound ID: | M070-1198 |
| Compound Name: | 3,5-dimethyl-N-{2-[(2-methylpropyl)sulfanyl]-1,3-benzothiazol-6-yl}-1,2-oxazole-4-sulfonamide |
| Molecular Weight: | 397.54 |
| Molecular Formula: | C16 H19 N3 O3 S3 |
| Smiles: | CC(C)CSc1nc2ccc(cc2s1)NS(c1c(C)noc1C)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.2766 |
| logD: | 4.2365 |
| logSw: | -4.237 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.008 |
| InChI Key: | BGJNTPOXWFVOMZ-UHFFFAOYSA-N |