3-{2-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl}-N-tert-butylpropanamide
Chemical Structure Depiction of
3-{2-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl}-N-tert-butylpropanamide
3-{2-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl}-N-tert-butylpropanamide
Compound characteristics
| Compound ID: | 2980-0021 |
| Compound Name: | 3-{2-[(5-bromo-2-hydroxyphenyl)methylidene]-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl}-N-tert-butylpropanamide |
| Molecular Weight: | 507.4 |
| Molecular Formula: | C21 H23 Br N4 O4 S |
| Smiles: | CC(C)(C)NC(CCN(C1c2ccccc2S(N=1)(=O)=O)/N=C/c1cc(ccc1O)[Br])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2509 |
| logD: | 3.2492 |
| logSw: | -3.566 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 91.017 |
| InChI Key: | ZEVMLDZNDUDOHD-UHFFFAOYSA-N |