N-tert-butyl-3-{2-[(2-chlorophenyl)methylidene]-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl}propanamide
Chemical Structure Depiction of
N-tert-butyl-3-{2-[(2-chlorophenyl)methylidene]-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl}propanamide
N-tert-butyl-3-{2-[(2-chlorophenyl)methylidene]-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl}propanamide
Compound characteristics
| Compound ID: | 4772-0642 |
| Compound Name: | N-tert-butyl-3-{2-[(2-chlorophenyl)methylidene]-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl}propanamide |
| Molecular Weight: | 446.95 |
| Molecular Formula: | C21 H23 Cl N4 O3 S |
| Smiles: | CC(C)(C)NC(CCN(C1c2ccccc2S(N=1)(=O)=O)/N=C/c1ccccc1[Cl])=O |
| Stereo: | ACHIRAL |
| logP: | 3.2863 |
| logD: | 3.2863 |
| logSw: | -3.7788 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.468 |
| InChI Key: | HIQMDPCBZFIEIH-UHFFFAOYSA-N |