3-chloro-N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2-methylbenzene-1-sulfonamide
3-chloro-N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-1914 |
| Compound Name: | 3-chloro-N-[2-(ethylsulfanyl)-1,3-benzothiazol-6-yl]-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 398.95 |
| Molecular Formula: | C16 H15 Cl N2 O2 S3 |
| Smiles: | CCSc1nc2ccc(cc2s1)NS(c1cccc(c1C)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 5.4813 |
| logD: | 5.0405 |
| logSw: | -5.9963 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 49.97 |
| InChI Key: | NGBVJNXGSRFNDD-UHFFFAOYSA-N |