N-[1-(adamantan-1-yl)ethyl]-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide
N-[1-(adamantan-1-yl)ethyl]-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide
Compound characteristics
| Compound ID: | E022-0812 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-2-(3-oxo-1,2-benzothiazol-2(3H)-yl)propanamide |
| Molecular Weight: | 384.54 |
| Molecular Formula: | C22 H28 N2 O2 S |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(C(C)N1C(c2ccccc2S1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.1975 |
| logD: | 4.1975 |
| logSw: | -4.3371 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 40.41 |
| InChI Key: | ZHCTXQYZKRTSBI-UHFFFAOYSA-N |