2-bromo-N-(2-cyanoethyl)-N'-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)benzohydrazide
Chemical Structure Depiction of
2-bromo-N-(2-cyanoethyl)-N'-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)benzohydrazide
2-bromo-N-(2-cyanoethyl)-N'-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)benzohydrazide
Compound characteristics
| Compound ID: | 6220-2831 |
| Compound Name: | 2-bromo-N-(2-cyanoethyl)-N'-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)benzohydrazide |
| Molecular Weight: | 433.28 |
| Molecular Formula: | C17 H13 Br N4 O3 S |
| Smiles: | C(CN(C(c1ccccc1[Br])=O)NC1c2ccccc2S(N=1)(=O)=O)C#N |
| Stereo: | ACHIRAL |
| logP: | 1.4414 |
| logD: | -1.2072 |
| logSw: | -2.3768 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 85.922 |
| InChI Key: | LYGXDNLHZUYNOV-UHFFFAOYSA-N |