3-[1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
Chemical Structure Depiction of
3-[1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
3-[1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
Compound characteristics
| Compound ID: | 2138-0004 |
| Compound Name: | 3-[1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile |
| Molecular Weight: | 250.28 |
| Molecular Formula: | C10 H10 N4 O2 S |
| Smiles: | C(CN(C1c2ccccc2S(N=1)(=O)=O)N)C#N |
| Stereo: | ACHIRAL |
| logP: | -0.2566 |
| logD: | -0.2566 |
| logSw: | -2.1117 |
| Hydrogen bond acceptors count: | 7 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 78.103 |
| InChI Key: | LPKMAUQNWZCJKH-UHFFFAOYSA-N |