1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8017-1963 |
| Compound Name: | 1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 427.63 |
| Molecular Formula: | C23 H29 N3 O S2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1CCN(CC1)C(CSc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 5.3539 |
| logD: | 5.3281 |
| logSw: | -5.634 |
| Hydrogen bond acceptors count: | 5 |
| Polar surface area: | 28.3929 |
| InChI Key: | FSJYRFKEMYLLNE-UHFFFAOYSA-N |