3-[2-{[4-(diethylamino)phenyl]methylidene}-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
Chemical Structure Depiction of
3-[2-{[4-(diethylamino)phenyl]methylidene}-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
3-[2-{[4-(diethylamino)phenyl]methylidene}-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile
Compound characteristics
| Compound ID: | 4772-0631 |
| Compound Name: | 3-[2-{[4-(diethylamino)phenyl]methylidene}-1-(1,1-dioxo-1H-1lambda~6~,2-benzothiazol-3-yl)hydrazinyl]propanenitrile |
| Molecular Weight: | 409.51 |
| Molecular Formula: | C21 H23 N5 O2 S |
| Smiles: | CCN(CC)c1ccc(/C=N/N(CCC#N)C2c3ccccc3S(N=2)(=O)=O)cc1 |
| Stereo: | ACHIRAL |
| logP: | 2.4008 |
| logD: | 2.3981 |
| logSw: | -2.7917 |
| Hydrogen bond acceptors count: | 7 |
| Polar surface area: | 71.401 |
| InChI Key: | SZRAKWLEDYSUQZ-UHFFFAOYSA-N |