2-(azepane-1-carbonyl)-N-(2,4-difluorophenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
2-(azepane-1-carbonyl)-N-(2,4-difluorophenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
2-(azepane-1-carbonyl)-N-(2,4-difluorophenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | L305-1616 |
| Compound Name: | 2-(azepane-1-carbonyl)-N-(2,4-difluorophenyl)-3-oxo-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 481.54 |
| Molecular Formula: | C21 H21 F2 N3 O4 S2 |
| Smiles: | C1CCCN(CC1)C(C1C(Nc2cc(ccc2S1)S(Nc1ccc(cc1F)F)(=O)=O)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.4726 |
| logD: | 1.0251 |
| logSw: | -3.8578 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 82.047 |
| InChI Key: | PXEAWXRXHOSBDA-IBGZPJMESA-N |