N-{2-[(3,5-dimethyladamantan-1-yl)oxy]ethyl}-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Chemical Structure Depiction of
N-{2-[(3,5-dimethyladamantan-1-yl)oxy]ethyl}-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
N-{2-[(3,5-dimethyladamantan-1-yl)oxy]ethyl}-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide
Compound characteristics
| Compound ID: | C849-1005 |
| Compound Name: | N-{2-[(3,5-dimethyladamantan-1-yl)oxy]ethyl}-4H-thieno[3,2-c][1]benzothiopyran-2-carboxamide |
| Molecular Weight: | 453.67 |
| Molecular Formula: | C26 H31 N O2 S2 |
| Smiles: | CC12CC3CC(C)(C1)CC(C3)(C2)OCCNC(c1cc2CSc3ccccc3c2s1)=O |
| Stereo: | ACHIRAL |
| logP: | 6.3539 |
| logD: | 6.3539 |
| logSw: | -5.677 |
| Hydrogen bond acceptors count: | 4 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 31.4214 |
| InChI Key: | KFMBXYXFYVSFKH-UHFFFAOYSA-N |