N-{3-[benzyl(methyl)amino]propyl}-2-{2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Chemical Structure Depiction of
N-{3-[benzyl(methyl)amino]propyl}-2-{2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
N-{3-[benzyl(methyl)amino]propyl}-2-{2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide
Compound characteristics
| Compound ID: | K788-3339 |
| Compound Name: | N-{3-[benzyl(methyl)amino]propyl}-2-{2-[(3-bromophenyl)methylidene]-3-oxo-2,3-dihydro-4H-1,4-benzothiazin-4-yl}acetamide |
| Molecular Weight: | 550.52 |
| Molecular Formula: | C28 H28 Br N3 O2 S |
| Smiles: | CN(CCCNC(CN1C(/C(=C\c2cccc(c2)[Br])Sc2ccccc12)=O)=O)Cc1ccccc1 |
| Stereo: | ACHIRAL |
| logP: | 5.1431 |
| logD: | 3.6459 |
| logSw: | -4.8751 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 43.477 |
| InChI Key: | NULLBDOMFMVAES-UHFFFAOYSA-N |