4-acetyl-N-[(4-bromophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
4-acetyl-N-[(4-bromophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
4-acetyl-N-[(4-bromophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | F053-0806 |
| Compound Name: | 4-acetyl-N-[(4-bromophenyl)methyl]-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 441.36 |
| Molecular Formula: | C17 H17 Br N2 O3 S2 |
| Smiles: | CC(N1CCSc2ccc(cc12)S(NCc1ccc(cc1)[Br])(=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.4271 |
| logD: | 3.4266 |
| logSw: | -3.9439 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 58.049 |
| InChI Key: | OQKMFZRXWCEDDT-UHFFFAOYSA-N |