N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-3-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-3-methoxybenzene-1-sulfonamide
N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-3-methoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0056 |
| Compound Name: | N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-3-methoxybenzene-1-sulfonamide |
| Molecular Weight: | 412.5 |
| Molecular Formula: | C16 H16 N2 O5 S3 |
| Smiles: | CCS(c1nc2ccc(cc2s1)NS(c1cccc(c1)OC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.094 |
| logD: | 2.9613 |
| logSw: | -3.4804 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 86.963 |
| InChI Key: | XJPCZPZXPUODCG-UHFFFAOYSA-N |