N-{[rel-(3R,4S)-3-(dimethylamino)-1-(thian-4-yl)piperidin-4-yl]methyl}-N'-methylurea
Chemical Structure Depiction of
N-{[rel-(3R,4S)-3-(dimethylamino)-1-(thian-4-yl)piperidin-4-yl]methyl}-N'-methylurea
N-{[rel-(3R,4S)-3-(dimethylamino)-1-(thian-4-yl)piperidin-4-yl]methyl}-N'-methylurea
Compound characteristics
| Compound ID: | S618-1971 |
| Compound Name: | N-{[rel-(3R,4S)-3-(dimethylamino)-1-(thian-4-yl)piperidin-4-yl]methyl}-N'-methylurea |
| Molecular Weight: | 314.49 |
| Molecular Formula: | C15 H30 N4 O S |
| Smiles: | CNC(NC[C@H]1CCN(C[C@H]1N(C)C)C1CCSCC1)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 0.2121 |
| logD: | -2.4018 |
| logSw: | -1.4332 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 40.738 |
| InChI Key: | BGFIYZPNSXJRKB-OCCSQVGLSA-N |