N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-5-fluoro-2-methylbenzene-1-sulfonamide
Chemical Structure Depiction of
N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-5-fluoro-2-methylbenzene-1-sulfonamide
N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-5-fluoro-2-methylbenzene-1-sulfonamide
Compound characteristics
| Compound ID: | M071-0102 |
| Compound Name: | N-[2-(ethanesulfonyl)-1,3-benzothiazol-6-yl]-5-fluoro-2-methylbenzene-1-sulfonamide |
| Molecular Weight: | 414.49 |
| Molecular Formula: | C16 H15 F N2 O4 S3 |
| Smiles: | CCS(c1nc2ccc(cc2s1)NS(c1cc(ccc1C)F)(=O)=O)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.6131 |
| logD: | 2.7852 |
| logSw: | -3.7662 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 79.42 |
| InChI Key: | MHEBQQBDJBGBBB-UHFFFAOYSA-N |