4-acetyl-N-[(3-bromophenyl)methyl]-2-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Chemical Structure Depiction of
4-acetyl-N-[(3-bromophenyl)methyl]-2-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
4-acetyl-N-[(3-bromophenyl)methyl]-2-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide
Compound characteristics
| Compound ID: | F053-2459 |
| Compound Name: | 4-acetyl-N-[(3-bromophenyl)methyl]-2-methyl-3,4-dihydro-2H-1,4-benzothiazine-6-sulfonamide |
| Molecular Weight: | 455.39 |
| Molecular Formula: | C18 H19 Br N2 O3 S2 |
| Smiles: | CC1CN(C(C)=O)c2cc(ccc2S1)S(NCc1cccc(c1)[Br])(=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.87 |
| logD: | 3.8696 |
| logSw: | -3.9926 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 57.982 |
| InChI Key: | AHKVWNLLXLOHNO-GFCCVEGCSA-N |