3-chloro-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
3-chloro-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-2-methylbenzene-1-sulfonamide
3-chloro-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0111 |
| Compound Name: | 3-chloro-N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 430.95 |
| Molecular Formula: | C16 H15 Cl N2 O4 S3 |
| Smiles: | CCS(c1nc2ccc(cc2s1)NS(c1cccc(c1C)[Cl])(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0641 |
| logD: | 3.2362 |
| logSw: | -4.2196 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.42 |
| InChI Key: | XAWGGKMNQVBDEH-UHFFFAOYSA-N |