3-fluoro-N-(2-{[(pyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzene-1-sulfonamide
Chemical Structure Depiction of
3-fluoro-N-(2-{[(pyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzene-1-sulfonamide
3-fluoro-N-(2-{[(pyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzene-1-sulfonamide
Compound characteristics
| Compound ID: | M070-1003 |
| Compound Name: | 3-fluoro-N-(2-{[(pyridin-3-yl)methyl]sulfanyl}-1,3-benzothiazol-6-yl)benzene-1-sulfonamide |
| Molecular Weight: | 431.53 |
| Molecular Formula: | C19 H14 F N3 O2 S3 |
| Smiles: | C(c1cccnc1)Sc1nc2ccc(cc2s1)NS(c1cccc(c1)F)(=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.3574 |
| logD: | 4.1514 |
| logSw: | -4.2452 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 59.216 |
| InChI Key: | IEUHFTQLPMIBIH-UHFFFAOYSA-N |