4-acetyl-N-(4-bromo-2-fluorophenyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
4-acetyl-N-(4-bromo-2-fluorophenyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
4-acetyl-N-(4-bromo-2-fluorophenyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | F053-0506 |
| Compound Name: | 4-acetyl-N-(4-bromo-2-fluorophenyl)-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 445.33 |
| Molecular Formula: | C16 H14 Br F N2 O3 S2 |
| Smiles: | CC(N1CCSc2ccc(cc12)S(Nc1ccc(cc1F)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.5034 |
| logD: | 1.0559 |
| logSw: | -3.9945 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 56.243 |
| InChI Key: | QXXAPZDCRHKCHV-UHFFFAOYSA-N |