N-{[rel-(3R,4S)-3-(dimethylamino)-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidin-4-yl]methyl}acetamide
Chemical Structure Depiction of
N-{[rel-(3R,4S)-3-(dimethylamino)-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidin-4-yl]methyl}acetamide
N-{[rel-(3R,4S)-3-(dimethylamino)-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidin-4-yl]methyl}acetamide
Compound characteristics
| Compound ID: | S618-0834 |
| Compound Name: | N-{[rel-(3R,4S)-3-(dimethylamino)-1-(1,3,5-trimethyl-1H-pyrazole-4-sulfonyl)piperidin-4-yl]methyl}acetamide |
| Molecular Weight: | 371.5 |
| Molecular Formula: | C16 H29 N5 O3 S |
| Smiles: | CC(NC[C@H]1CCN(C[C@H]1N(C)C)S(c1c(C)nn(C)c1C)(=O)=O)=O |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | -1.3385 |
| logD: | -1.6729 |
| logSw: | -1.5313 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 73.217 |
| InChI Key: | JBKCMYFJKYOGKP-CABCVRRESA-N |