N-[2-(4-chlorophenoxy)ethyl]-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-[2-(4-chlorophenoxy)ethyl]-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide
N-[2-(4-chlorophenoxy)ethyl]-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | 8013-0058 |
| Compound Name: | N-[2-(4-chlorophenoxy)ethyl]-2-(methylsulfanyl)-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 414.95 |
| Molecular Formula: | C16 H15 Cl N2 O3 S3 |
| Smiles: | CSc1nc2ccc(cc2s1)S(NCCOc1ccc(cc1)[Cl])(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.9804 |
| logD: | 4.9802 |
| logSw: | -4.9352 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.337 |
| InChI Key: | ZFDAKCTYBVQOQX-UHFFFAOYSA-N |