3-[2-benzylidene-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide
Chemical Structure Depiction of
3-[2-benzylidene-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide
3-[2-benzylidene-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide
Compound characteristics
| Compound ID: | 4772-0426 |
| Compound Name: | 3-[2-benzylidene-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]-N-tert-butylpropanamide |
| Molecular Weight: | 412.51 |
| Molecular Formula: | C21 H24 N4 O3 S |
| Smiles: | CC(C)(C)NC(CCN(C1c2ccccc2S(N=1)(=O)=O)/N=C/c1ccccc1)=O |
| Stereo: | ACHIRAL |
| logP: | 2.4459 |
| logD: | 2.4459 |
| logSw: | -3.084 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.468 |
| InChI Key: | CDWOOOZOVUWQMH-UHFFFAOYSA-N |