4-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile
Chemical Structure Depiction of
4-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile
4-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | G856-9482 |
| Compound Name: | 4-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile |
| Molecular Weight: | 376.48 |
| Molecular Formula: | C21 H20 N4 O S |
| Smiles: | Cc1ccc2c(c1C)nc(N1CCN(CC1)C(c1ccc(C#N)cc1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 4.1009 |
| logD: | 4.1008 |
| logSw: | -4.0863 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 47.509 |
| InChI Key: | VXJKLHBWAMSOLQ-UHFFFAOYSA-N |