rel-(3R,4R)-1-(4-chloro-2-methylbenzene-1-sulfonyl)-4-(1-methylpiperidin-4-yl)pyrrolidine-3-carboxamide
Chemical Structure Depiction of
rel-(3R,4R)-1-(4-chloro-2-methylbenzene-1-sulfonyl)-4-(1-methylpiperidin-4-yl)pyrrolidine-3-carboxamide
rel-(3R,4R)-1-(4-chloro-2-methylbenzene-1-sulfonyl)-4-(1-methylpiperidin-4-yl)pyrrolidine-3-carboxamide
Compound characteristics
| Compound ID: | S632-0692 |
| Compound Name: | rel-(3R,4R)-1-(4-chloro-2-methylbenzene-1-sulfonyl)-4-(1-methylpiperidin-4-yl)pyrrolidine-3-carboxamide |
| Molecular Weight: | 399.94 |
| Molecular Formula: | C18 H26 Cl N3 O3 S |
| Smiles: | Cc1cc(ccc1S(N1C[C@@H](C2CCN(C)CC2)[C@@H](C1)C(N)=O)(=O)=O)[Cl] |
| Stereo: | RACEMIC MIXTURE (RELATIVE) |
| logP: | 1.9334 |
| logD: | 0.581 |
| logSw: | -2.9296 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 69.638 |
| InChI Key: | VTLLKZREOXFNCY-JKSUJKDBSA-N |