N-[1-(adamantan-1-yl)ethyl]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
Chemical Structure Depiction of
N-[1-(adamantan-1-yl)ethyl]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
N-[1-(adamantan-1-yl)ethyl]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide
Compound characteristics
| Compound ID: | E022-1420 |
| Compound Name: | N-[1-(adamantan-1-yl)ethyl]-4-(3-oxo-1,2-benzothiazol-2(3H)-yl)butanamide |
| Molecular Weight: | 398.57 |
| Molecular Formula: | C23 H30 N2 O2 S |
| Smiles: | CC(C12CC3CC(CC(C3)C2)C1)NC(CCCN1C(c2ccccc2S1)=O)=O |
| Stereo: | RACEMIC MIXTURE |
| logP: | 3.5991 |
| logD: | 3.5991 |
| logSw: | -3.9044 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 41.273 |
| InChI Key: | BGFZQCLPEXYZKA-SCUMNGBJSA-N |