4-[(2S,4R)-1-(1-benzylpiperidin-4-yl)-4-hydroxypyrrolidine-2-carbonyl]-1lambda~6~-thiomorpholine-1,1-dione
Chemical Structure Depiction of
4-[(2S,4R)-1-(1-benzylpiperidin-4-yl)-4-hydroxypyrrolidine-2-carbonyl]-1lambda~6~-thiomorpholine-1,1-dione
4-[(2S,4R)-1-(1-benzylpiperidin-4-yl)-4-hydroxypyrrolidine-2-carbonyl]-1lambda~6~-thiomorpholine-1,1-dione
Compound characteristics
| Compound ID: | S596-2316 |
| Compound Name: | 4-[(2S,4R)-1-(1-benzylpiperidin-4-yl)-4-hydroxypyrrolidine-2-carbonyl]-1lambda~6~-thiomorpholine-1,1-dione |
| Molecular Weight: | 421.56 |
| Molecular Formula: | C21 H31 N3 O4 S |
| Smiles: | C1CN(CCC1N1C[C@@H](C[C@H]1C(N1CCS(CC1)(=O)=O)=O)O)Cc1ccccc1 |
| Stereo: | ABSOLUTE |
| logP: | -0.1277 |
| logD: | -0.7141 |
| logSw: | -1.9196 |
| Hydrogen bond acceptors count: | 9 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 67.499 |
| InChI Key: | KWASMEGBHZDBNM-PMACEKPBSA-N |