{(2S,4R)-4-hydroxy-1-[1-(oxan-4-yl)piperidin-4-yl]pyrrolidin-2-yl}(4-phenylpiperazin-1-yl)methanone
Chemical Structure Depiction of
{(2S,4R)-4-hydroxy-1-[1-(oxan-4-yl)piperidin-4-yl]pyrrolidin-2-yl}(4-phenylpiperazin-1-yl)methanone
{(2S,4R)-4-hydroxy-1-[1-(oxan-4-yl)piperidin-4-yl]pyrrolidin-2-yl}(4-phenylpiperazin-1-yl)methanone
Compound characteristics
| Compound ID: | S596-0357 |
| Compound Name: | {(2S,4R)-4-hydroxy-1-[1-(oxan-4-yl)piperidin-4-yl]pyrrolidin-2-yl}(4-phenylpiperazin-1-yl)methanone |
| Molecular Weight: | 442.6 |
| Molecular Formula: | C25 H38 N4 O3 |
| Smiles: | C1CN(CCC1N1C[C@@H](C[C@H]1C(N1CCN(CC1)c1ccccc1)=O)O)C1CCOCC1 |
| Stereo: | ABSOLUTE |
| logP: | 1.7056 |
| logD: | -0.0211 |
| logSw: | -1.9044 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 50.15 |
| InChI Key: | OKTRVSWRFVOFLG-ZEQRLZLVSA-N |