N-(2-bromophenyl)-4-[(4-fluorophenyl)methyl]-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
Chemical Structure Depiction of
N-(2-bromophenyl)-4-[(4-fluorophenyl)methyl]-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
N-(2-bromophenyl)-4-[(4-fluorophenyl)methyl]-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide
Compound characteristics
| Compound ID: | C531-0028 |
| Compound Name: | N-(2-bromophenyl)-4-[(4-fluorophenyl)methyl]-1,3-dioxo-1,2,3,4-tetrahydro-1lambda~4~,4-benzothiazine-6-carboxamide |
| Molecular Weight: | 487.35 |
| Molecular Formula: | C22 H16 Br F N2 O3 S |
| Smiles: | C(c1ccc(cc1)F)N1C(CS(c2ccc(cc12)C(Nc1ccccc1[Br])=O)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 3.7476 |
| logD: | 3.7474 |
| logSw: | -4.219 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 53.169 |
| InChI Key: | NSZDVUXEAWHNRU-UHFFFAOYSA-N |