3-chloro-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-4-methoxybenzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-4-methoxybenzene-1-sulfonamide
3-chloro-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-4-methoxybenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0086 |
| Compound Name: | 3-chloro-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-4-methoxybenzene-1-sulfonamide |
| Molecular Weight: | 446.95 |
| Molecular Formula: | C16 H15 Cl N2 O5 S3 |
| Smiles: | CCS(c1nc2ccc(cc2s1)NS(c1ccc(c(c1)[Cl])OC)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.3908 |
| logD: | 3.3446 |
| logSw: | -3.7449 |
| Hydrogen bond acceptors count: | 10 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 87.05 |
| InChI Key: | BTSWVEHXRJOLDC-UHFFFAOYSA-N |