1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(1H-benzimidazol-2-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(1H-benzimidazol-2-yl)sulfanyl]ethan-1-one
1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(1H-benzimidazol-2-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8017-1383 |
| Compound Name: | 1-[4-(adamantan-1-yl)piperazin-1-yl]-2-[(1H-benzimidazol-2-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 410.58 |
| Molecular Formula: | C23 H30 N4 O S |
| Smiles: | C1C2CC3CC1CC(C2)(C3)N1CCN(CC1)C(CSc1nc2ccccc2[nH]1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.0082 |
| logD: | 3.982 |
| logSw: | -4.2615 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 37.325 |
| InChI Key: | BRIDMNYKWPBDTM-UHFFFAOYSA-N |