1-(adamantan-1-yl)-2-[(1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
Chemical Structure Depiction of
1-(adamantan-1-yl)-2-[(1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
1-(adamantan-1-yl)-2-[(1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one
Compound characteristics
| Compound ID: | 8014-2489 |
| Compound Name: | 1-(adamantan-1-yl)-2-[(1,3-benzothiazol-2-yl)sulfanyl]ethan-1-one |
| Molecular Weight: | 343.51 |
| Molecular Formula: | C19 H21 N O S2 |
| Smiles: | C1C2CC3CC1CC(C2)(C3)C(CSc1nc2ccccc2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.1229 |
| logD: | 6.1229 |
| logSw: | -5.9669 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 22.3286 |
| InChI Key: | XTARDDSYOVQIMI-UHFFFAOYSA-N |