N-(2-fluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Chemical Structure Depiction of
N-(2-fluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
N-(2-fluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide
Compound characteristics
| Compound ID: | F952-0057 |
| Compound Name: | N-(2-fluorophenyl)-2-oxo-3-[3-oxo-3-(pyrrolidin-1-yl)propyl]-2,3-dihydro-1,3-benzothiazole-6-sulfonamide |
| Molecular Weight: | 449.52 |
| Molecular Formula: | C20 H20 F N3 O4 S2 |
| Smiles: | C1CCN(C1)C(CCN1C(=O)Sc2cc(ccc12)S(Nc1ccccc1F)(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.2857 |
| logD: | 3.1385 |
| logSw: | -3.8159 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 72.5 |
| InChI Key: | CYHWUGZMEWQNOS-UHFFFAOYSA-N |