N-{2-[(adamantan-1-yl)sulfanyl]ethyl}-3,5-dimethoxybenzamide
Chemical Structure Depiction of
N-{2-[(adamantan-1-yl)sulfanyl]ethyl}-3,5-dimethoxybenzamide
N-{2-[(adamantan-1-yl)sulfanyl]ethyl}-3,5-dimethoxybenzamide
Compound characteristics
| Compound ID: | 8019-6527 |
| Compound Name: | N-{2-[(adamantan-1-yl)sulfanyl]ethyl}-3,5-dimethoxybenzamide |
| Molecular Weight: | 375.53 |
| Molecular Formula: | C21 H29 N O3 S |
| Smiles: | COc1cc(cc(c1)OC)C(NCCSC12CC3CC(CC(C3)C2)C1)=O |
| Stereo: | ACHIRAL |
| logP: | 4.5189 |
| logD: | 4.5189 |
| logSw: | -4.3064 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 39.614 |
| InChI Key: | MNHDBNAVLIBCDF-UHFFFAOYSA-N |