4-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile
Chemical Structure Depiction of
4-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile
4-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile
Compound characteristics
| Compound ID: | G856-9056 |
| Compound Name: | 4-[4-(4-methoxy-1,3-benzothiazol-2-yl)piperazine-1-carbonyl]benzonitrile |
| Molecular Weight: | 378.45 |
| Molecular Formula: | C20 H18 N4 O2 S |
| Smiles: | COc1cccc2c1nc(N1CCN(CC1)C(c1ccc(C#N)cc1)=O)s2 |
| Stereo: | ACHIRAL |
| logP: | 3.1708 |
| logD: | 3.1708 |
| logSw: | -3.1905 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 55.139 |
| InChI Key: | XXOTVQAODGEHIR-UHFFFAOYSA-N |