1-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]pentan-1-one
Chemical Structure Depiction of
1-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]pentan-1-one
1-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]pentan-1-one
Compound characteristics
| Compound ID: | G856-9490 |
| Compound Name: | 1-[4-(4,5-dimethyl-1,3-benzothiazol-2-yl)piperazin-1-yl]pentan-1-one |
| Molecular Weight: | 331.48 |
| Molecular Formula: | C18 H25 N3 O S |
| Smiles: | CCCCC(N1CCN(CC1)c1nc2c(C)c(C)ccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.4597 |
| logD: | 4.4596 |
| logSw: | -4.1589 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 30.197 |
| InChI Key: | XJZFOBARLGSUJL-UHFFFAOYSA-N |