{(2S,4R)-4-hydroxy-1-[1-(oxan-4-yl)piperidin-4-yl]pyrrolidin-2-yl}[4-(pyrimidin-2-yl)piperazin-1-yl]methanone
Chemical Structure Depiction of
{(2S,4R)-4-hydroxy-1-[1-(oxan-4-yl)piperidin-4-yl]pyrrolidin-2-yl}[4-(pyrimidin-2-yl)piperazin-1-yl]methanone
{(2S,4R)-4-hydroxy-1-[1-(oxan-4-yl)piperidin-4-yl]pyrrolidin-2-yl}[4-(pyrimidin-2-yl)piperazin-1-yl]methanone
Compound characteristics
| Compound ID: | S596-2358 |
| Compound Name: | {(2S,4R)-4-hydroxy-1-[1-(oxan-4-yl)piperidin-4-yl]pyrrolidin-2-yl}[4-(pyrimidin-2-yl)piperazin-1-yl]methanone |
| Molecular Weight: | 444.58 |
| Molecular Formula: | C23 H36 N6 O3 |
| Smiles: | C1CN(CCC1N1C[C@@H](C[C@H]1C(N1CCN(CC1)c1ncccn1)=O)O)C1CCOCC1 |
| Stereo: | ABSOLUTE |
| logP: | 0.8702 |
| logD: | -0.8564 |
| logSw: | -0.8774 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 68.512 |
| InChI Key: | LFYHEDDKNYNNAU-SFTDATJTSA-N |